Found 14 hits with Last Name = 'kumar' and Initial = 'us' 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
(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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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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PC cid PC sid UniChem
Patents
Similars
| PubMed
| n/a | n/a | 3.49E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of Xanthine oxidase |
Bioorg Med Chem Lett 13: 2777-80 (2003)
BindingDB Entry DOI: 10.7270/Q2M61KS0 |
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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PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.49E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
J Nat Prod 68: 1615-21 (2005)
Article DOI: 10.1021/np058036y BindingDB Entry DOI: 10.7270/Q2TT4QQZ |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50250503
((-)-specioside | CHEMBL516849)Show SMILES OC[C@H]1O[C@@H](O[C@@H]2OC=C[C@H]3[C@H](O\C=C\c4ccc(O)cc4)[C@@H]4O[C@@]4(CO)[C@@H]23)[C@H](O)[C@@H](O)[C@@H]1O |r,c:8| Show InChI InChI=1S/C23H28O11/c24-9-14-16(27)17(28)18(29)22(32-14)33-21-15-13(6-8-31-21)19(20-23(15,10-25)34-20)30-7-5-11-1-3-12(26)4-2-11/h1-8,13-22,24-29H,9-10H2/b7-5+/t13-,14-,15-,16-,17+,18-,19+,20+,21+,22+,23+/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 7.99E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
J Nat Prod 68: 1615-21 (2005)
Article DOI: 10.1021/np058036y BindingDB Entry DOI: 10.7270/Q2TT4QQZ |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50131452
(CHEMBL92193 | Hexadecanoic acid (2S,3R)-2-(3,4-dih...)Show SMILES CCCCCCCCCCCCCCCC(=O)O[C@@H]1Cc2ccc(O)c(O)c2O[C@H]1c1ccc(O)c(O)c1 Show InChI InChI=1S/C31H44O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-28(35)37-27-21-23-17-19-25(33)29(36)31(23)38-30(27)22-16-18-24(32)26(34)20-22/h16-20,27,30,32-34,36H,2-15,21H2,1H3/t27-,30+/m1/s1 | PDB MMDB
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| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 9.47E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of Xanthine oxidase |
Bioorg Med Chem Lett 13: 2777-80 (2003)
BindingDB Entry DOI: 10.7270/Q2M61KS0 |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50250506
((+)-cycloolivil | CHEMBL516536)Show SMILES COc1cc2C[C@@](O)(CO)[C@H](CO)[C@@H](c3ccc(O)c(OC)c3)c2cc1O |r| Show InChI InChI=1S/C20H24O7/c1-26-17-5-11(3-4-15(17)23)19-13-7-16(24)18(27-2)6-12(13)8-20(25,10-22)14(19)9-21/h3-7,14,19,21-25H,8-10H2,1-2H3/t14-,19+,20-/m1/s1 | PDB MMDB
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CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.01E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
J Nat Prod 68: 1615-21 (2005)
Article DOI: 10.1021/np058036y BindingDB Entry DOI: 10.7270/Q2TT4QQZ |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50131446
(CHEMBL419512 | Tetradecanoic acid (2S,3R)-2-(3,4-d...)Show SMILES CCCCCCCCCCCCCC(=O)O[C@@H]1Cc2ccc(O)c(O)c2O[C@H]1c1ccc(O)c(O)c1 Show InChI InChI=1S/C29H40O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-26(33)35-25-19-21-15-17-23(31)27(34)29(21)36-28(25)20-14-16-22(30)24(32)18-20/h14-18,25,28,30-32,34H,2-13,19H2,1H3/t25-,28+/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of Xanthine oxidase |
Bioorg Med Chem Lett 13: 2777-80 (2003)
BindingDB Entry DOI: 10.7270/Q2M61KS0 |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50250507
(7'-hydroxydivanillyltetrahydrofuran | CHEMBL517783)Show SMILES COc1cc(C[C@@H]2COC[C@@H]2C(O)c2ccc(O)c(OC)c2)ccc1O |r| Show InChI InChI=1S/C20H24O6/c1-24-18-8-12(3-5-16(18)21)7-14-10-26-11-15(14)20(23)13-4-6-17(22)19(9-13)25-2/h3-6,8-9,14-15,20-23H,7,10-11H2,1-2H3/t14-,15+,20?/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.11E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
J Nat Prod 68: 1615-21 (2005)
Article DOI: 10.1021/np058036y BindingDB Entry DOI: 10.7270/Q2TT4QQZ |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50131450
(CHEMBL94460 | Decanoic acid (2S,3R)-2-(3,4-dihydro...)Show SMILES CCCCCCCCCC(=O)O[C@@H]1Cc2ccc(O)c(O)c2O[C@H]1c1ccc(O)c(O)c1 Show InChI InChI=1S/C25H32O7/c1-2-3-4-5-6-7-8-9-22(29)31-21-15-17-11-13-19(27)23(30)25(17)32-24(21)16-10-12-18(26)20(28)14-16/h10-14,21,24,26-28,30H,2-9,15H2,1H3/t21-,24+/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.12E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of Xanthine oxidase |
Bioorg Med Chem Lett 13: 2777-80 (2003)
BindingDB Entry DOI: 10.7270/Q2M61KS0 |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50131456
(CHEMBL327396 | Hexanoic acid (2S,3R)-2-(3,4-dihydr...)Show SMILES CCCCCC(=O)O[C@@H]1Cc2ccc(O)c(O)c2O[C@H]1c1ccc(O)c(O)c1 Show InChI InChI=1S/C21H24O7/c1-2-3-4-5-18(25)27-17-11-13-7-9-15(23)19(26)21(13)28-20(17)12-6-8-14(22)16(24)10-12/h6-10,17,20,22-24,26H,2-5,11H2,1H3/t17-,20+/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.29E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of Xanthine oxidase |
Bioorg Med Chem Lett 13: 2777-80 (2003)
BindingDB Entry DOI: 10.7270/Q2M61KS0 |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50131453
(Butyric acid (2S,3R)-2-(3,4-dihydroxy-phenyl)-7,8-...)Show SMILES CCCC(=O)O[C@@H]1Cc2ccc(O)c(O)c2O[C@H]1c1ccc(O)c(O)c1 Show InChI InChI=1S/C19H20O7/c1-2-3-16(23)25-15-9-11-5-7-13(21)17(24)19(11)26-18(15)10-4-6-12(20)14(22)8-10/h4-8,15,18,20-22,24H,2-3,9H2,1H3/t15-,18+/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.39E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of Xanthine oxidase |
Bioorg Med Chem Lett 13: 2777-80 (2003)
BindingDB Entry DOI: 10.7270/Q2M61KS0 |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50131451
(Acetic acid (2S,3R)-2-(3,4-dihydroxy-phenyl)-7,8-d...)Show SMILES CC(=O)O[C@@H]1Cc2ccc(O)c(O)c2O[C@H]1c1ccc(O)c(O)c1 Show InChI InChI=1S/C17H16O7/c1-8(18)23-14-7-10-3-5-12(20)15(22)17(10)24-16(14)9-2-4-11(19)13(21)6-9/h2-6,14,16,19-22H,7H2,1H3/t14-,16+/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of Xanthine oxidase |
Bioorg Med Chem Lett 13: 2777-80 (2003)
BindingDB Entry DOI: 10.7270/Q2M61KS0 |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50250502
((-)-6-feruloyl-catalpol | CHEMBL463912)Show SMILES COc1cc(\C=C\O[C@@H]2[C@@H]3O[C@@]3(CO)[C@@H]3[C@H]2C=CO[C@H]3O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O |r,c:18| Show InChI InChI=1S/C24H30O12/c1-31-14-8-11(2-3-13(14)27)4-6-32-20-12-5-7-33-22(16(12)24(10-26)21(20)36-24)35-23-19(30)18(29)17(28)15(9-25)34-23/h2-8,12,15-23,25-30H,9-10H2,1H3/b6-4+/t12-,15-,16-,17-,18+,19-,20+,21+,22+,23+,24+/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
J Nat Prod 68: 1615-21 (2005)
Article DOI: 10.1021/np058036y BindingDB Entry DOI: 10.7270/Q2TT4QQZ |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50131449
(CHEMBL317730 | Octadecanoic acid (2S,3R)-2-(3,4-di...)Show SMILES CCCCCCCCCCCCCCCCCC(=O)O[C@@H]1Cc2ccc(O)c(O)c2O[C@H]1c1ccc(O)c(O)c1 Show InChI InChI=1S/C33H48O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-30(37)39-29-23-25-19-21-27(35)31(38)33(25)40-32(29)24-18-20-26(34)28(36)22-24/h18-22,29,32,34-36,38H,2-17,23H2,1H3/t29-,32+/m1/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 1.56E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of Xanthine oxidase |
Bioorg Med Chem Lett 13: 2777-80 (2003)
BindingDB Entry DOI: 10.7270/Q2M61KS0 |
More data for this Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Homo sapiens (Human)) | BDBM50250505
((-)-(2R,3R)-Secoisolariciresinol | (-)-secoisolari...)Show SMILES COc1cc(C[C@@H](CO)[C@H](CO)C(O)c2ccc(O)c(OC)c2)ccc1O |r| Show InChI InChI=1S/C20H26O7/c1-26-18-8-12(3-5-16(18)23)7-14(10-21)15(11-22)20(25)13-4-6-17(24)19(9-13)27-2/h3-6,8-9,14-15,20-25H,7,10-11H2,1-2H3/t14-,15-,20?/m0/s1 | PDB MMDB
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UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Chemical Technology
Curated by ChEMBL
| Assay Description Inhibition of xanthine oxidase (unknown origin) |
J Nat Prod 68: 1615-21 (2005)
Article DOI: 10.1021/np058036y BindingDB Entry DOI: 10.7270/Q2TT4QQZ |
More data for this Ligand-Target Pair | |