Found 8 hits of Enzyme Inhibition Constant Data 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| Purchase
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)) | 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
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| 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)) | 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
KEGG
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)) | 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
KEGG
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
KEGG
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
KEGG
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
KEGG
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)) | 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
KEGG
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 | |
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