Compile Data Set for Download or QSAR
Found 14 Enz. Inhib. hit(s) with all data for entry = 50018606
TargetProstaglandin G/H synthase 2(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM22369(4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofu...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1
Show InChI InChI=1S/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3
Affinity DataIC50: 500nMAssay Description:Inhibition of ovine COX2 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 2(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197398(3-(4-chlorophenyl)-4-(4-methylsulfonamidophenyl)-2...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=C(C(=O)OC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H14ClNO4S/c1-24(21,22)19-14-8-4-11(5-9-14)15-10-23-17(20)16(15)12-2-6-13(18)7-3-12/h2-9,19H,10H2,1H3
Affinity DataIC50: 800nMAssay Description:Inhibition of ovine COX2 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 2(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197396(3-(4-methylphenyl)-4-(4-methylsulfonamidophenyl)-2...)
Show SMILES Cc1ccc(cc1)C1=C(COC1=O)c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C18H17NO4S/c1-12-3-5-14(6-4-12)17-16(11-23-18(17)20)13-7-9-15(10-8-13)19-24(2,21)22/h3-10,19H,11H2,1-2H3
Affinity DataIC50: 900nMAssay Description:Inhibition of ovine COX2 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 2(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197394(4-(4-methylsulfonamidophenyl)-3-phenyl-2(5H)furano...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1
Show InChI InChI=1S/C17H15NO4S/c1-23(20,21)18-14-9-7-12(8-10-14)15-11-22-17(19)16(15)13-5-3-2-4-6-13/h2-10,18H,11H2,1H3
Affinity DataIC50: 1.70E+3nMAssay Description:Inhibition of ovine COX2 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 2(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197397(3-(4-fluorophenyl)-4-(4-methylsulfonamidophenyl)-2...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=C(C(=O)OC1)c1ccc(F)cc1
Show InChI InChI=1S/C17H14FNO4S/c1-24(21,22)19-14-8-4-11(5-9-14)15-10-23-17(20)16(15)12-2-6-13(18)7-3-12/h2-9,19H,10H2,1H3
Affinity DataIC50: 3.20E+3nMAssay Description:Inhibition of ovine COX2 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 2(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197395(3-(4-bromophenyl)-4-(4-methylsulfonamidophenyl)-2(...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=C(C(=O)OC1)c1ccc(Br)cc1
Show InChI InChI=1S/C17H14BrNO4S/c1-24(21,22)19-14-8-4-11(5-9-14)15-10-23-17(20)16(15)12-2-6-13(18)7-3-12/h2-9,19H,10H2,1H3
Affinity DataIC50: 3.20E+3nMAssay Description:Inhibition of ovine COX2 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197397(3-(4-fluorophenyl)-4-(4-methylsulfonamidophenyl)-2...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=C(C(=O)OC1)c1ccc(F)cc1
Show InChI InChI=1S/C17H14FNO4S/c1-24(21,22)19-14-8-4-11(5-9-14)15-10-23-17(20)16(15)12-2-6-13(18)7-3-12/h2-9,19H,10H2,1H3
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of ovine COX1 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197398(3-(4-chlorophenyl)-4-(4-methylsulfonamidophenyl)-2...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=C(C(=O)OC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C17H14ClNO4S/c1-24(21,22)19-14-8-4-11(5-9-14)15-10-23-17(20)16(15)12-2-6-13(18)7-3-12/h2-9,19H,10H2,1H3
Affinity DataIC50: 3.15E+4nMAssay Description:Inhibition of ovine COX1 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 2(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197393(3-(4-methoxyphenyl)-4-(4-methylsulfonamidophenyl)-...)
Show SMILES COc1ccc(cc1)C1=C(COC1=O)c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C18H17NO5S/c1-23-15-9-5-13(6-10-15)17-16(11-24-18(17)20)12-3-7-14(8-4-12)19-25(2,21)22/h3-10,19H,11H2,1-2H3
Affinity DataIC50: 3.15E+4nMAssay Description:Inhibition of ovine COX2 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197394(4-(4-methylsulfonamidophenyl)-3-phenyl-2(5H)furano...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1
Show InChI InChI=1S/C17H15NO4S/c1-23(20,21)18-14-9-7-12(8-10-14)15-11-22-17(19)16(15)13-5-3-2-4-6-13/h2-10,18H,11H2,1H3
Affinity DataIC50: 3.16E+4nMAssay Description:Inhibition of ovine COX1 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197395(3-(4-bromophenyl)-4-(4-methylsulfonamidophenyl)-2(...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=C(C(=O)OC1)c1ccc(Br)cc1
Show InChI InChI=1S/C17H14BrNO4S/c1-24(21,22)19-14-8-4-11(5-9-14)15-10-23-17(20)16(15)12-2-6-13(18)7-3-12/h2-9,19H,10H2,1H3
Affinity DataIC50: 3.55E+4nMAssay Description:Inhibition of ovine COX1 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM22369(4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofu...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1
Show InChI InChI=1S/C17H14O4S/c1-22(19,20)14-9-7-12(8-10-14)15-11-21-17(18)16(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of ovine COX1 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197396(3-(4-methylphenyl)-4-(4-methylsulfonamidophenyl)-2...)
Show SMILES Cc1ccc(cc1)C1=C(COC1=O)c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C18H17NO4S/c1-12-3-5-14(6-4-12)17-16(11-23-18(17)20)13-7-9-15(10-8-13)19-24(2,21)22/h3-10,19H,11H2,1-2H3
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of ovine COX1 by enzyme immunoassayMore data for this Ligand-Target Pair
TargetProstaglandin G/H synthase 1(Ovis aries (Sheep))
University of Alberta Edmonton

Curated by ChEMBL
LigandPNGBDBM50197393(3-(4-methoxyphenyl)-4-(4-methylsulfonamidophenyl)-...)
Show SMILES COc1ccc(cc1)C1=C(COC1=O)c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C18H17NO5S/c1-23-15-9-5-13(6-10-15)17-16(11-24-18(17)20)12-3-7-14(8-4-12)19-25(2,21)22/h3-10,19H,11H2,1-2H3
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of ovine COX1 by enzyme immunoassayMore data for this Ligand-Target Pair