BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 42 hits with Last Name = 'balaji' and Initial = 's'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2939
PNG
(4-(2-cyclopropylethynyl)-5-fluoro-4-(trifluorometh...)
Show SMILES Fc1cccc2NC(=O)OC(C#CC3CC3)(c12)C(F)(F)F
Show InChI InChI=1S/C14H9F4NO2/c15-9-2-1-3-10-11(9)13(14(16,17)18,21-12(20)19-10)7-6-8-4-5-8/h1-3,8H,4-5H2,(H,19,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 78n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2942
PNG
(5-fluoro-4-(3-methylbut-1-yn-1-yl)-4-(trifluoromet...)
Show SMILES CC(C)C#CC1(OC(=O)Nc2cccc(F)c12)C(F)(F)F
Show InChI InChI=1S/C14H11F4NO2/c1-8(2)6-7-13(14(16,17)18)11-9(15)4-3-5-10(11)19-12(20)21-13/h3-5,8H,1-2H3,(H,19,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 102n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2940
PNG
(4-(but-1-yn-1-yl)-5-fluoro-4-(trifluoromethyl)-2,4...)
Show SMILES CCC#CC1(OC(=O)Nc2cccc(F)c12)C(F)(F)F
Show InChI InChI=1S/C13H9F4NO2/c1-2-3-7-12(13(15,16)17)10-8(14)5-4-6-9(10)18-11(19)20-12/h4-6H,2H2,1H3,(H,18,19)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 127n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2941
PNG
(5-fluoro-4-(pent-1-yn-1-yl)-4-(trifluoromethyl)-2,...)
Show SMILES CCCC#CC1(OC(=O)Nc2cccc(F)c12)C(F)(F)F
Show InChI InChI=1S/C14H11F4NO2/c1-2-3-4-8-13(14(16,17)18)11-9(15)6-5-7-10(11)19-12(20)21-13/h5-7H,2-3H2,1H3,(H,19,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 156n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2946
PNG
(4-(3-methylbut-1-yn-1-yl)-6-nitro-4-(trifluorometh...)
Show SMILES CC(C)C#CC1(OC(=O)Nc2ccc(cc12)[N+]([O-])=O)C(F)(F)F
Show InChI InChI=1S/C14H11F3N2O4/c1-8(2)5-6-13(14(15,16)17)10-7-9(19(21)22)3-4-11(10)18-12(20)23-13/h3-4,7-8H,1-2H3,(H,18,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 199n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2943
PNG
(4-(2-cyclopropylethynyl)-6-nitro-4-(trifluoromethy...)
Show SMILES [O-][N+](=O)c1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F
Show InChI InChI=1S/C14H9F3N2O4/c15-14(16,17)13(6-5-8-1-2-8)10-7-9(19(21)22)3-4-11(10)18-12(20)23-13/h3-4,7-8H,1-2H2,(H,18,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 209n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50333138
PNG
(2-((4-methoxyphenoxy)methyl)-7-methyl-5H-[1,3,4]th...)
Show SMILES COc1ccc(OCc2nn3c(nc(C)cc3=O)s2)cc1
Show InChI InChI=1S/C14H13N3O3S/c1-9-7-13(18)17-14(15-9)21-12(16-17)8-20-11-5-3-10(19-2)4-6-11/h3-7H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 269n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2944
PNG
(4-(but-1-yn-1-yl)-6-nitro-4-(trifluoromethyl)-2,4-...)
Show SMILES CCC#CC1(OC(=O)Nc2ccc(cc12)[N+]([O-])=O)C(F)(F)F
Show InChI InChI=1S/C13H9F3N2O4/c1-2-3-6-12(13(14,15)16)9-7-8(18(20)21)4-5-10(9)17-11(19)22-12/h4-5,7H,2H2,1H3,(H,17,19)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 276n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333138
PNG
(2-((4-methoxyphenoxy)methyl)-7-methyl-5H-[1,3,4]th...)
Show SMILES COc1ccc(OCc2nn3c(nc(C)cc3=O)s2)cc1
Show InChI InChI=1S/C14H13N3O3S/c1-9-7-13(18)17-14(15-9)21-12(16-17)8-20-11-5-3-10(19-2)4-6-11/h3-7H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 289n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2945
PNG
(6-nitro-4-(pent-1-yn-1-yl)-4-(trifluoromethyl)-2,4...)
Show SMILES CCCC#CC1(OC(=O)Nc2ccc(cc12)[N+]([O-])=O)C(F)(F)F
Show InChI InChI=1S/C14H11F3N2O4/c1-2-3-4-7-13(14(15,16)17)10-8-9(19(21)22)5-6-11(10)18-12(20)23-13/h5-6,8H,2-3H2,1H3,(H,18,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 304n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50333141
PNG
(7-methyl-2-(o-tolyloxymethyl)-5H-[1,3,4]thiadiazol...)
Show SMILES Cc1cc(=O)n2nc(COc3ccccc3C)sc2n1
Show InChI InChI=1S/C14H13N3O2S/c1-9-5-3-4-6-11(9)19-8-12-16-17-13(18)7-10(2)15-14(17)20-12/h3-7H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 326n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333141
PNG
(7-methyl-2-(o-tolyloxymethyl)-5H-[1,3,4]thiadiazol...)
Show SMILES Cc1cc(=O)n2nc(COc3ccccc3C)sc2n1
Show InChI InChI=1S/C14H13N3O2S/c1-9-5-3-4-6-11(9)19-8-12-16-17-13(18)7-10(2)15-14(17)20-12/h3-7H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 362n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333140
PNG
(2-((2-bromophenoxy)methyl)-7-methyl-5H-[1,3,4]thia...)
Show SMILES Cc1cc(=O)n2nc(COc3ccccc3Br)sc2n1
Show InChI InChI=1S/C13H10BrN3O2S/c1-8-6-12(18)17-13(15-8)20-11(16-17)7-19-10-5-3-2-4-9(10)14/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 413n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333139
PNG
(2-((4-chlorophenoxy)methyl)-7-methyl-5H-[1,3,4]thi...)
Show SMILES Cc1cc(=O)n2nc(COc3ccc(Cl)cc3)sc2n1
Show InChI InChI=1S/C13H10ClN3O2S/c1-8-6-12(18)17-13(15-8)20-11(16-17)7-19-10-4-2-9(14)3-5-10/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 449n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50333139
PNG
(2-((4-chlorophenoxy)methyl)-7-methyl-5H-[1,3,4]thi...)
Show SMILES Cc1cc(=O)n2nc(COc3ccc(Cl)cc3)sc2n1
Show InChI InChI=1S/C13H10ClN3O2S/c1-8-6-12(18)17-13(15-8)20-11(16-17)7-19-10-4-2-9(14)3-5-10/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 461n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2952
PNG
(6-(methylamino)-4-(3-methylbut-1-yn-1-yl)-4-(trifl...)
Show SMILES CNc1ccc2NC(=O)OC(C#CC(C)C)(c2c1)C(F)(F)F
Show InChI InChI=1S/C15H15F3N2O2/c1-9(2)6-7-14(15(16,17)18)11-8-10(19-3)4-5-12(11)20-13(21)22-14/h4-5,8-9,19H,1-3H3,(H,20,21)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 473n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333137
PNG
(7-methyl-2-(phenoxymethyl)-5H-[1,3,4]thiadiazolo[3...)
Show SMILES Cc1cc(=O)n2nc(COc3ccccc3)sc2n1
Show InChI InChI=1S/C13H11N3O2S/c1-9-7-12(17)16-13(14-9)19-11(15-16)8-18-10-5-3-2-4-6-10/h2-7H,8H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 555n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333147
PNG
(2-((2-fluorophenoxy)methyl)-7-methyl-5H-[1,3,4]thi...)
Show SMILES Cc1cc(=O)n2nc(COc3ccccc3F)sc2n1
Show InChI InChI=1S/C13H10FN3O2S/c1-8-6-12(18)17-13(15-8)20-11(16-17)7-19-10-5-3-2-4-9(10)14/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 590n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50333140
PNG
(2-((2-bromophenoxy)methyl)-7-methyl-5H-[1,3,4]thia...)
Show SMILES Cc1cc(=O)n2nc(COc3ccccc3Br)sc2n1
Show InChI InChI=1S/C13H10BrN3O2S/c1-8-6-12(18)17-13(15-8)20-11(16-17)7-19-10-5-3-2-4-9(10)14/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 603n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2951
PNG
(4-(2-cyclopropylethynyl)-6-(methylamino)-4-(triflu...)
Show SMILES CNc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F
Show InChI InChI=1S/C15H13F3N2O2/c1-19-10-4-5-12-11(8-10)14(15(16,17)18,22-13(21)20-12)7-6-9-2-3-9/h4-5,8-9,19H,2-3H2,1H3,(H,20,21)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 608n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333143
PNG
(2-((4-chloro-3-methylphenoxy)methyl)-7-methyl-5H-[...)
Show SMILES Cc1cc(=O)n2nc(COc3ccc(Cl)c(C)c3)sc2n1
Show InChI InChI=1S/C14H12ClN3O2S/c1-8-5-10(3-4-11(8)15)20-7-12-17-18-13(19)6-9(2)16-14(18)21-12/h3-6H,7H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 623n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50333143
PNG
(2-((4-chloro-3-methylphenoxy)methyl)-7-methyl-5H-[...)
Show SMILES Cc1cc(=O)n2nc(COc3ccc(Cl)c(C)c3)sc2n1
Show InChI InChI=1S/C14H12ClN3O2S/c1-8-5-10(3-4-11(8)15)20-7-12-17-18-13(19)6-9(2)16-14(18)21-12/h3-6H,7H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 634n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM35440
PNG
(ALLOPURINOL | MLS000069453 | SMR000059083 | cid_20...)
Show SMILES O=c1[nH]cnc2n[nH]cc12
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

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 730n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM35440
PNG
(ALLOPURINOL | MLS000069453 | SMR000059083 | cid_20...)
Show SMILES O=c1[nH]cnc2n[nH]cc12
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

PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 753n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2947
PNG
(6-amino-4-(2-cyclopropylethynyl)-4-(trifluoromethy...)
Show SMILES Nc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F
Show InChI InChI=1S/C14H11F3N2O2/c15-14(16,17)13(6-5-8-1-2-8)10-7-9(18)3-4-11(10)19-12(20)21-13/h3-4,7-8H,1-2,18H2,(H,19,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 802n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2950
PNG
(6-amino-4-(3-methylbut-1-yn-1-yl)-4-(trifluorometh...)
Show SMILES CC(C)C#CC1(OC(=O)Nc2ccc(N)cc12)C(F)(F)F
Show InChI InChI=1S/C14H13F3N2O2/c1-8(2)5-6-13(14(15,16)17)10-7-9(18)3-4-11(10)19-12(20)21-13/h3-4,7-8H,18H2,1-2H3,(H,19,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 896n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333133
PNG
(7-methyl-2-(p-tolyloxymethyl)-5H-[1,3,4]thiadiazol...)
Show SMILES Cc1ccc(OCc2nn3c(nc(C)cc3=O)s2)cc1
Show InChI InChI=1S/C14H13N3O2S/c1-9-3-5-11(6-4-9)19-8-12-16-17-13(18)7-10(2)15-14(17)20-12/h3-7H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.02E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50333144
PNG
(7-methyl-2-(m-tolyloxymethyl)-5H-[1,3,4]thiadiazol...)
Show SMILES Cc1cccc(OCc2nn3c(nc(C)cc3=O)s2)c1
Show InChI InChI=1S/C14H13N3O2S/c1-9-4-3-5-11(6-9)19-8-12-16-17-13(18)7-10(2)15-14(17)20-12/h3-7H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.03E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333144
PNG
(7-methyl-2-(m-tolyloxymethyl)-5H-[1,3,4]thiadiazol...)
Show SMILES Cc1cccc(OCc2nn3c(nc(C)cc3=O)s2)c1
Show InChI InChI=1S/C14H13N3O2S/c1-9-4-3-5-11(6-9)19-8-12-16-17-13(18)7-10(2)15-14(17)20-12/h3-7H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.07E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2949
PNG
(6-amino-4-(pent-1-yn-1-yl)-4-(trifluoromethyl)-2,4...)
Show SMILES CCCC#CC1(OC(=O)Nc2ccc(N)cc12)C(F)(F)F
Show InChI InChI=1S/C14H13F3N2O2/c1-2-3-4-7-13(14(15,16)17)10-8-9(18)5-6-11(10)19-12(20)21-13/h5-6,8H,2-3,18H2,1H3,(H,19,20)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.51E+3n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50333142
PNG
(2-((2-chlorophenoxy)methyl)-7-methyl-5H-[1,3,4]thi...)
Show SMILES Cc1cc(=O)n2nc(COc3ccccc3Cl)sc2n1
Show InChI InChI=1S/C13H10ClN3O2S/c1-8-6-12(18)17-13(15-8)20-11(16-17)7-19-10-5-3-2-4-9(10)14/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.65E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333146
PNG
(2-((2,4-dimethylphenoxy)methyl)-7-methyl-5H-[1,3,4...)
Show SMILES Cc1ccc(OCc2nn3c(nc(C)cc3=O)s2)c(C)c1
Show InChI InChI=1S/C15H15N3O2S/c1-9-4-5-12(10(2)6-9)20-8-13-17-18-14(19)7-11(3)16-15(18)21-13/h4-7H,8H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.76E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50333146
PNG
(2-((2,4-dimethylphenoxy)methyl)-7-methyl-5H-[1,3,4...)
Show SMILES Cc1ccc(OCc2nn3c(nc(C)cc3=O)s2)c(C)c1
Show InChI InChI=1S/C15H15N3O2S/c1-9-4-5-12(10(2)6-9)20-8-13-17-18-14(19)7-11(3)16-15(18)21-13/h4-7H,8H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333142
PNG
(2-((2-chlorophenoxy)methyl)-7-methyl-5H-[1,3,4]thi...)
Show SMILES Cc1cc(=O)n2nc(COc3ccccc3Cl)sc2n1
Show InChI InChI=1S/C13H10ClN3O2S/c1-8-6-12(18)17-13(15-8)20-11(16-17)7-19-10-5-3-2-4-9(10)14/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.83E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2948
PNG
(6-amino-4-(but-1-yn-1-yl)-4-(trifluoromethyl)-2,4-...)
Show SMILES CCC#CC1(OC(=O)Nc2ccc(N)cc12)C(F)(F)F
Show InChI InChI=1S/C13H11F3N2O2/c1-2-3-6-12(13(14,15)16)9-7-8(17)4-5-10(9)18-11(19)20-12/h4-5,7H,2,17H2,1H3,(H,18,19)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.89E+3n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333136
PNG
(2-((3-fluorophenoxy)methyl)-7-methyl-5H-[1,3,4]thi...)
Show SMILES Cc1cc(=O)n2nc(COc3cccc(F)c3)sc2n1
Show InChI InChI=1S/C13H10FN3O2S/c1-8-5-12(18)17-13(15-8)20-11(16-17)7-19-10-4-2-3-9(14)6-10/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.98E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2954
PNG
(Benzoxazinone deriv. 8b | CHEMBL111598 | N-[4-(3-m...)
Show SMILES CC(C)C#CC1(OC(=O)Nc2ccc(NC(C)=O)cc12)C(F)(F)F
Show InChI InChI=1S/C16H15F3N2O3/c1-9(2)6-7-15(16(17,18)19)12-8-11(20-10(3)22)4-5-13(12)21-14(23)24-15/h4-5,8-9H,1-3H3,(H,20,22)(H,21,23)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a<2.00E+3n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)
BDBM2953
PNG
(Benzoxazinone deriv. 8a | CHEMBL111492 | N-[4-(2-c...)
Show SMILES CC(=O)Nc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F
Show InChI InChI=1S/C16H13F3N2O3/c1-9(22)20-11-4-5-13-12(8-11)15(16(17,18)19,24-14(23)21-13)7-6-10-2-3-10/h4-5,8,10H,2-3H2,1H3,(H,20,22)(H,21,23)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>2.00E+3n/an/an/an/an/an/a



S.G.S.I.T.S.

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase


Bioorg Med Chem Lett 14: 6089-94 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.068
BindingDB Entry DOI: 10.7270/Q2XS5TVZ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333145
PNG
(7-methyl-2-((4-nitrophenoxy)methyl)-5H-[1,3,4]thia...)
Show SMILES Cc1cc(=O)n2nc(COc3ccc(cc3)[N+]([O-])=O)sc2n1
Show InChI InChI=1S/C13H10N4O4S/c1-8-6-12(18)16-13(14-8)22-11(15-16)7-21-10-4-2-9(3-5-10)17(19)20/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.03E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))
BDBM50333145
PNG
(7-methyl-2-((4-nitrophenoxy)methyl)-5H-[1,3,4]thia...)
Show SMILES Cc1cc(=O)n2nc(COc3ccc(cc3)[N+]([O-])=O)sc2n1
Show InChI InChI=1S/C13H10N4O4S/c1-8-6-12(18)16-13(14-8)22-11(15-16)7-21-10-4-2-9(3-5-10)17(19)20/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.50E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of bovine milk xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333135
PNG
(2-((3-bromophenoxy)methyl)-7-methyl-5H-[1,3,4]thia...)
Show SMILES Cc1cc(=O)n2nc(COc3cccc(Br)c3)sc2n1
Show InChI InChI=1S/C13H10BrN3O2S/c1-8-5-12(18)17-13(15-8)20-11(16-17)7-19-10-4-2-3-9(14)6-10/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.56E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Rattus norvegicus)
BDBM50333134
PNG
(2-((3-chlorophenoxy)methyl)-7-methyl-5H-[1,3,4]thi...)
Show SMILES Cc1cc(=O)n2nc(COc3cccc(Cl)c3)sc2n1
Show InChI InChI=1S/C13H10ClN3O2S/c1-8-5-12(18)17-13(15-8)20-11(16-17)7-19-10-4-2-3-9(14)6-10/h2-6H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.18E+3n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat liver xanthine oxidase by spectrophotometry


Bioorg Med Chem 19: 211-20 (2011)


Article DOI: 10.1016/j.bmc.2010.11.034
BindingDB Entry DOI: 10.7270/Q26H4HPB
More data for this
Ligand-Target Pair