Found 22 hits Enz. Inhib. hit(s) with all data for entry = 50027704 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)) | BDBM50254494
(2-(3-chloro-4-isobutoxyphenylamino)-2-oxoacetic ac...)Show InChI InChI=1S/C12H14ClNO4/c1-7(2)6-18-10-4-3-8(5-9(10)13)14-11(15)12(16)17/h3-5,7H,6H2,1-2H3,(H,14,15)(H,16,17) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 7.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
More data for this
Ligand-Target Pair | |
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 | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50254495
(1-(4-isobutoxy-3-nitrophenyl)-3-(pyridin-4-yl)urea...)Show SMILES CC(C)COc1ccc(NC(=O)Nc2ccncc2)cc1[N+]([O-])=O Show InChI InChI=1S/C16H18N4O4/c1-11(2)10-24-15-4-3-13(9-14(15)20(22)23)19-16(21)18-12-5-7-17-8-6-12/h3-9,11H,10H2,1-2H3,(H2,17,18,19,21) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 1.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 2.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50254561
(2-(methoxymethoxy)-5-(5-(2-methylpyridin-4-yl)-2H-...)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 | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 2.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 3.10E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50254496
(4-(3-(4-isobutoxy-3-nitrophenyl)-1H-1,2,4-triazol-...)Show SMILES CC(C)COc1ccc(cc1[N+]([O-])=O)-c1nnc([nH]1)-c1ccncc1 Show InChI InChI=1S/C17H17N5O3/c1-11(2)10-25-15-4-3-13(9-14(15)22(23)24)17-19-16(20-21-17)12-5-7-18-8-6-12/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 | 3.37E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 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 | 4.30E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 6.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 6.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 1.10E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
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 | 5.90E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50254501
(2-isobutoxy-5-(5-(2-methylpyridin-4-yl)-2H-1,2,4-t...)Show SMILES CC(C)COc1ccc(cc1C(O)=O)-c1nnc([nH]1)-c1ccnc(C)c1 Show InChI InChI=1S/C19H20N4O3/c1-11(2)10-26-16-5-4-13(9-15(16)19(24)25)17-21-18(23-22-17)14-6-7-20-12(3)8-14/h4-9,11H,10H2,1-3H3,(H,24,25)(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 | >1.00E+7 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50254553
(2-(5-(4-isobutoxy-3-nitrophenyl)-1H-1,2,4-triazol-...)Show SMILES CC(C)COc1ccc(cc1[N+]([O-])=O)-c1nnc([nH]1)-c1ccccn1 Show InChI InChI=1S/C17H17N5O3/c1-11(2)10-25-15-7-6-12(9-14(15)22(23)24)16-19-17(21-20-16)13-5-3-4-8-18-13/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 | >1.00E+7 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50254556
(4-(5-(4-isobutoxy-3-nitrophenyl)-1H-1,2,4-triazol-...)Show SMILES COc1cc(ccn1)-c1nnc([nH]1)-c1ccc(OCC(C)C)c(c1)[N+]([O-])=O Show InChI InChI=1S/C18H19N5O4/c1-11(2)10-27-15-5-4-12(8-14(15)23(24)25)17-20-18(22-21-17)13-6-7-19-16(9-13)26-3/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 | >1.00E+7 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
More data for this
Ligand-Target Pair | |
Xanthine dehydrogenase/oxidase
(Bos taurus (Bovine)) | BDBM50254557
(2-chloro-4-(5-(4-isobutoxy-3-nitrophenyl)-1H-1,2,4...)Show SMILES CC(C)COc1ccc(cc1[N+]([O-])=O)-c1nnc([nH]1)-c1cc(C)nc(Cl)c1 Show InChI InChI=1S/C18H18ClN5O3/c1-10(2)9-27-15-5-4-12(7-14(15)24(25)26)17-21-18(23-22-17)13-6-11(3)20-16(19)8-13/h4-8,10H,9H2,1-3H3,(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 | >1.00E+7 | n/a | n/a | n/a | n/a | n/a | n/a |
Fuji Yakuhin Co, Ltd
Curated by ChEMBL
| Assay Description
Inhibition of bovine milk xanthine oxidoreductase |
Bioorg Med Chem Lett 19: 184-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.10.122
BindingDB Entry DOI: 10.7270/Q2DR2VBH |
More data for this
Ligand-Target Pair | |
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