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Compile Data Set for Download or QSAR

Found 84 hits with Last Name = 'abdelgawad' and Initial = 'ma'   
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
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222084
PNG
(6-(4-nitrophenyl)-2-oxo-4-(thiophen-2-yl)-1,2-dihy...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(-c2cccs2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C16H9N3O3S/c17-9-13-12(15-2-1-7-23-15)8-14(18-16(13)20)10-3-5-11(6-4-10)19(21)22/h1-8H,(H,18,20)
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n/an/a 870n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222088
PNG
(4-(4-Fluorophenyl)-6-(4-isobutylphenyl)-2-oxo-1,2-...)
Show SMILES CC(C)Cc1ccc(cc1)-c1cc(-c2ccc(F)cc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C22H19FN2O/c1-14(2)11-15-3-5-17(6-4-15)21-12-19(20(13-24)22(26)25-21)16-7-9-18(23)10-8-16/h3-10,12,14H,11H2,1-2H3,(H,25,26)
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n/an/a 930n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222089
PNG
(4-(2-Furyl)-6-(4-isobutylphenyl)-2-oxo-1,2-dihydro...)
Show SMILES CC(C)Cc1ccc(cc1)-c1cc(-c2ccco2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C20H18N2O2/c1-13(2)10-14-5-7-15(8-6-14)18-11-16(19-4-3-9-24-19)17(12-21)20(23)22-18/h3-9,11,13H,10H2,1-2H3,(H,22,23)
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n/an/a 1.11E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222083
PNG
(4-(2-Furyl)-6-(4-nitrophenyl)-2-oxo-1,2-dihydropyr...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(-c2ccco2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C16H9N3O4/c17-9-13-12(15-2-1-7-23-15)8-14(18-16(13)20)10-3-5-11(6-4-10)19(21)22/h1-8H,(H,18,20)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222097
PNG
(1-(4-Aminosulfonylphenyl)-3-(4-methanesulfonylamin...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C22H22N4O4S2/c1-31(27,28)25-18-9-7-16(8-10-18)21-15-22(17-5-3-2-4-6-17)26(24-21)19-11-13-20(14-12-19)32(23,29)30/h2-14,22,25H,15H2,1H3,(H2,23,29,30)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222092
PNG
(6-(4-Methanesulfonylaminophenyl)-2-oxo-4-(4-tolyl)...)
Show SMILES Cc1ccc(cc1)-c1cc([nH]c(=O)c1C#N)-c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C20H17N3O3S/c1-13-3-5-14(6-4-13)17-11-19(22-20(24)18(17)12-21)15-7-9-16(10-8-15)23-27(2,25)26/h3-11,23H,1-2H3,(H,22,24)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM11639
PNG
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
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n/an/a 1.33E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cyclooxygenase-2 (COX-2)


(Homo sapiens (Human))
BDBM11639
PNG
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
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n/an/a 1.33E+3n/an/an/an/an/an/a



Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222091
PNG
(6-(4-Methanesulfonylaminophenyl)-2-oxo-4-phenyl-1,...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1cc(-c2ccccc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C19H15N3O3S/c1-26(24,25)22-15-9-7-14(8-10-15)18-11-16(13-5-3-2-4-6-13)17(12-20)19(23)21-18/h2-11,22H,1H3,(H,21,23)
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n/an/a 1.60E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Cyclooxygenase-2 (COX-2)


(Homo sapiens (Human))
BDBM175286
PNG
(3-(4-Aminosulfonylphenylamino)-2-(4-fluorophenyl)-...)
Show SMILES CC1SC(N(Nc2ccc(cc2)S(N)(=O)=O)C1=O)c1ccc(F)cc1
Show InChI InChI=1S/C16H16FN3O3S2/c1-10-15(21)20(16(24-10)11-2-4-12(17)5-3-11)19-13-6-8-14(9-7-13)25(18,22)23/h2-10,16,19H,1H3,(H2,18,22,23)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
Cyclooxygenase-2 (COX-2)


(Homo sapiens (Human))
BDBM175285
PNG
(3-(4-Aminosulfonylphenylamino)-2-(4-chlorophenyl)-...)
Show SMILES CC1SC(N(Nc2ccc(cc2)S(N)(=O)=O)C1=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H16ClN3O3S2/c1-10-15(21)20(16(24-10)11-2-4-12(17)5-3-11)19-13-6-8-14(9-7-13)25(18,22)23/h2-10,16,19H,1H3,(H2,18,22,23)
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Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222099
PNG
(1-(4-Aminosulfonylphenyl)-5-(4-chlorophenyl)-3-(4-...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=NN(C(C1)c1ccc(Cl)cc1)c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C22H21ClN4O4S2/c1-32(28,29)26-18-8-4-15(5-9-18)21-14-22(16-2-6-17(23)7-3-16)27(25-21)19-10-12-20(13-11-19)33(24,30)31/h2-13,22,26H,14H2,1H3,(H2,24,30,31)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222094
PNG
(4-(4-Fluorophenyl)-6-(4-methanesulfonylaminophenyl...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1cc(-c2ccc(F)cc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C19H14FN3O3S/c1-27(25,26)23-15-8-4-13(5-9-15)18-10-16(17(11-21)19(24)22-18)12-2-6-14(20)7-3-12/h2-10,23H,1H3,(H,22,24)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222086
PNG
(6-(4-Isobutylphenyl)-2-oxo-4-(p-tolyl)-1,2-dihydro...)
Show SMILES CC(C)Cc1ccc(cc1)-c1cc(-c2ccc(C)cc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C23H22N2O/c1-15(2)12-17-6-10-19(11-7-17)22-13-20(21(14-24)23(26)25-22)18-8-4-16(3)5-9-18/h4-11,13,15H,12H2,1-3H3,(H,25,26)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222095
PNG
(4-(2-Furyl)-6-(4-methanesulfonylaminophenyl)-2-oxo...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1cc(-c2ccco2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C17H13N3O4S/c1-25(22,23)20-12-6-4-11(5-7-12)15-9-13(16-3-2-8-24-16)14(10-18)17(21)19-15/h2-9,20H,1H3,(H,19,21)
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n/an/a 2.90E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222080
PNG
(6-(4-Nitrophenyl)-2-oxo-4-(p-tolyl)-1,2-dihydropyr...)
Show SMILES Cc1ccc(cc1)-c1cc([nH]c(=O)c1C#N)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C19H13N3O3/c1-12-2-4-13(5-3-12)16-10-18(21-19(23)17(16)11-20)14-6-8-15(9-7-14)22(24)25/h2-10H,1H3,(H,21,23)
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Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222085
PNG
(6-(4-Isobutylphenyl)-2-oxo-4-phenyl-1,2-dihydropyr...)
Show SMILES CC(C)Cc1ccc(cc1)-c1cc(-c2ccccc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C22H20N2O/c1-15(2)12-16-8-10-18(11-9-16)21-13-19(17-6-4-3-5-7-17)20(14-23)22(25)24-21/h3-11,13,15H,12H2,1-2H3,(H,24,25)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Cyclooxygenase-2 (COX-2)


(Homo sapiens (Human))
BDBM60580
PNG
(3-(4-Aminosulfonylphenylamino)-5-methyl-2-(4-trifl...)
Show SMILES CC1SC(N(Nc2ccc(cc2)S(N)(=O)=O)C1=O)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H16F3N3O3S2/c1-10-15(24)23(22-13-6-8-14(9-7-13)28(21,25)26)16(27-10)11-2-4-12(5-3-11)17(18,19)20/h2-10,16,22H,1H3,(H2,21,25,26)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222093
PNG
(4-(4-Chlorophenyl)-6-(4-methanesulfonylaminophenyl...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1cc(-c2ccc(Cl)cc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C19H14ClN3O3S/c1-27(25,26)23-15-8-4-13(5-9-15)18-10-16(17(11-21)19(24)22-18)12-2-6-14(20)7-3-12/h2-10,23H,1H3,(H,22,24)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222101
PNG
(1-(4-Aminosulfonylphenyl)-5-(2-furyl)-3-(4-methane...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=NN(C(C1)c1ccco1)c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C20H20N4O5S2/c1-30(25,26)23-15-6-4-14(5-7-15)18-13-19(20-3-2-12-29-20)24(22-18)16-8-10-17(11-9-16)31(21,27)28/h2-12,19,23H,13H2,1H3,(H2,21,27,28)
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n/an/a 3.50E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222090
PNG
(6-(4-Isobutylphenyl)-2-oxo-4-(2-thienyl)-1,2-dihyd...)
Show SMILES CC(C)Cc1ccc(cc1)-c1cc(-c2cccs2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C20H18N2OS/c1-13(2)10-14-5-7-15(8-6-14)18-11-16(19-4-3-9-24-19)17(12-21)20(23)22-18/h3-9,11,13H,10H2,1-2H3,(H,22,23)
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n/an/a 3.70E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222079
PNG
(6-(4-nitrophenyl)-2-oxo-4-phenyl-1,2-dihydropyridi...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(-c2ccccc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C18H11N3O3/c19-11-16-15(12-4-2-1-3-5-12)10-17(20-18(16)22)13-6-8-14(9-7-13)21(23)24/h1-10H,(H,20,22)
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n/an/a 3.80E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222100
PNG
(1-(4-Aminosulfonylphenyl)-5-(4-fluorophenyl)-3-(4-...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=NN(C(C1)c1ccc(F)cc1)c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C22H21FN4O4S2/c1-32(28,29)26-18-8-4-15(5-9-18)21-14-22(16-2-6-17(23)7-3-16)27(25-21)19-10-12-20(13-11-19)33(24,30)31/h2-13,22,26H,14H2,1H3,(H2,24,30,31)
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n/an/a 3.90E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM181101
PNG
(N-(3,4,5-trimethoxybenzylidene)-2-(3,6-dimethyl-1-...)
Show SMILES COc1cc(\C=N\NC(=O)COc2cc(C)nc3n(nc(C)c23)-c2ccccc2)cc(OC)c1OC
Show InChI InChI=1S/C26H27N5O5/c1-16-11-20(24-17(2)30-31(26(24)28-16)19-9-7-6-8-10-19)36-15-23(32)29-27-14-18-12-21(33-3)25(35-5)22(13-18)34-4/h6-14H,15H2,1-5H3,(H,29,32)/b27-14+
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n/an/a 4.18E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
Kinase activity was determined using Kinase-Glo Plus luminescence kinase assay kit according to the manufacturer instructions. The assays depend on t...


Bioorg Chem 66: 88-96 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.011
BindingDB Entry DOI: 10.7270/Q2VQ31GF
More data for this
Ligand-Target Pair
Cyclooxygenase-2 (COX-2)


(Homo sapiens (Human))
BDBM175280
PNG
(2-(4-(4-Nitrophenyl)thiazol-2-ylimino)thiazolidin-...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1csc(N=C2NC(=O)CS2)n1
Show InChI InChI=1S/C12H8N4O3S2/c17-10-6-21-12(14-10)15-11-13-9(5-20-11)7-1-3-8(4-2-7)16(18)19/h1-5H,6H2,(H,13,14,15,17)
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n/an/a 4.60E+3n/an/an/an/an/an/a



Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222082
PNG
(4-(4-Fluorophenyl)-6-(4-nitrophenyl)-2-oxo-1,2-dih...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(-c2ccc(F)cc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C18H10FN3O3/c19-13-5-1-11(2-6-13)15-9-17(21-18(23)16(15)10-20)12-3-7-14(8-4-12)22(24)25/h1-9H,(H,21,23)
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Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM181097
PNG
(N-(4-methoxybenzylidene)-2-(3,6-dimethyl-1-phenyl-...)
Show SMILES COc1ccc(\C=N\NC(=O)COc2cc(C)nc3n(nc(C)c23)-c2ccccc2)cc1
Show InChI InChI=1S/C24H23N5O3/c1-16-13-21(23-17(2)28-29(24(23)26-16)19-7-5-4-6-8-19)32-15-22(30)27-25-14-18-9-11-20(31-3)12-10-18/h4-14H,15H2,1-3H3,(H,27,30)/b25-14+
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n/an/a 4.72E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
Kinase activity was determined using Kinase-Glo Plus luminescence kinase assay kit according to the manufacturer instructions. The assays depend on t...


Bioorg Chem 66: 88-96 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.011
BindingDB Entry DOI: 10.7270/Q2VQ31GF
More data for this
Ligand-Target Pair
Cyclooxygenase-2 (COX-2)


(Homo sapiens (Human))
BDBM175284
PNG
(3-(4-Aminosulfonylphenylamino)-5-methyl-2-(4-methy...)
Show SMILES CC1SC(N(Nc2ccc(cc2)S(N)(=O)=O)C1=O)c1ccc(C)cc1
Show InChI InChI=1S/C17H19N3O3S2/c1-11-3-5-13(6-4-11)17-20(16(21)12(2)24-17)19-14-7-9-15(10-8-14)25(18,22)23/h3-10,12,17,19H,1-2H3,(H2,18,22,23)
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n/an/a 4.80E+3n/an/an/an/an/an/a



Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM181098
PNG
(N-(4-chlorobenzylidene)-2-(3,6-dimethyl-1-phenyl-1...)
Show SMILES Cc1nn(-c2ccccc2)c2nc(C)cc(OCC(=O)N\N=C\c3ccc(Cl)cc3)c12
Show InChI InChI=1S/C23H20ClN5O2/c1-15-12-20(31-14-21(30)27-25-13-17-8-10-18(24)11-9-17)22-16(2)28-29(23(22)26-15)19-6-4-3-5-7-19/h3-13H,14H2,1-2H3,(H,27,30)/b25-13+
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n/an/a 5.01E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
Kinase activity was determined using Kinase-Glo Plus luminescence kinase assay kit according to the manufacturer instructions. The assays depend on t...


Bioorg Chem 66: 88-96 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.011
BindingDB Entry DOI: 10.7270/Q2VQ31GF
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222087
PNG
(4-(4-Chlorophenyl)-6-(4-isobutylphenyl)-2-oxo-1,2-...)
Show SMILES CC(C)Cc1ccc(cc1)-c1cc(-c2ccc(Cl)cc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C22H19ClN2O/c1-14(2)11-15-3-5-17(6-4-15)21-12-19(20(13-24)22(26)25-21)16-7-9-18(23)10-8-16/h3-10,12,14H,11H2,1-2H3,(H,25,26)
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n/an/a 5.10E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Cyclooxygenase-2 (COX-2)


(Homo sapiens (Human))
BDBM175282
PNG
(2-(4-(4-Methanesulfonamidophenyl)thiazol-2-ylimino...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1csc(\N=C2\NC(=O)CS2)n1
Show InChI InChI=1S/C13H12N4O3S3/c1-23(19,20)17-9-4-2-8(3-5-9)10-6-21-12(14-10)16-13-15-11(18)7-22-13/h2-6,17H,7H2,1H3,(H,14,15,16,18)
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n/an/a 5.30E+3n/an/an/an/an/an/a



Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
Cyclooxygenase-2 (COX-2)


(Homo sapiens (Human))
BDBM175281
PNG
(2-(4-(4-Isobutylphenyl)thiazol-2-ylimino)thiazolid...)
Show SMILES CC(C)Cc1ccc(cc1)-c1csc(N=C2NC(=O)CS2)n1
Show InChI InChI=1S/C16H17N3OS2/c1-10(2)7-11-3-5-12(6-4-11)13-8-21-15(17-13)19-16-18-14(20)9-22-16/h3-6,8,10H,7,9H2,1-2H3,(H,17,18,19,20)
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n/an/a 6.10E+3n/an/an/an/an/an/a



Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222088
PNG
(4-(4-Fluorophenyl)-6-(4-isobutylphenyl)-2-oxo-1,2-...)
Show SMILES CC(C)Cc1ccc(cc1)-c1cc(-c2ccc(F)cc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C22H19FN2O/c1-14(2)11-15-3-5-17(6-4-15)21-12-19(20(13-24)22(26)25-21)16-7-9-18(23)10-8-16/h3-10,12,14H,11H2,1-2H3,(H,25,26)
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n/an/a 6.50E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222084
PNG
(6-(4-nitrophenyl)-2-oxo-4-(thiophen-2-yl)-1,2-dihy...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(-c2cccs2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C16H9N3O3S/c17-9-13-12(15-2-1-7-23-15)8-14(18-16(13)20)10-3-5-11(6-4-10)19(21)22/h1-8H,(H,18,20)
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n/an/a 6.80E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222081
PNG
(4-(4-chlorophenyl)-6-(4-nitrophenyl)-2-oxo-1,2-dih...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(-c2ccc(Cl)cc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C18H10ClN3O3/c19-13-5-1-11(2-6-13)15-9-17(21-18(23)16(15)10-20)12-3-7-14(8-4-12)22(24)25/h1-9H,(H,21,23)
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n/an/a 7.30E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222089
PNG
(4-(2-Furyl)-6-(4-isobutylphenyl)-2-oxo-1,2-dihydro...)
Show SMILES CC(C)Cc1ccc(cc1)-c1cc(-c2ccco2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C20H18N2O2/c1-13(2)10-14-5-7-15(8-6-14)18-11-16(19-4-3-9-24-19)17(12-21)20(23)22-18/h3-9,11,13H,10H2,1-2H3,(H,22,23)
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Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222098
PNG
(1-(4-Aminosulfonylphenyl)-3-(4-methanesulfonylamin...)
Show SMILES Cc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C23H24N4O4S2/c1-16-3-5-18(6-4-16)23-15-22(17-7-9-19(10-8-17)26-32(2,28)29)25-27(23)20-11-13-21(14-12-20)33(24,30)31/h3-14,23,26H,15H2,1-2H3,(H2,24,30,31)
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Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222097
PNG
(1-(4-Aminosulfonylphenyl)-3-(4-methanesulfonylamin...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=NN(C(C1)c1ccccc1)c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C22H22N4O4S2/c1-31(27,28)25-18-9-7-16(8-10-18)21-15-22(17-5-3-2-4-6-17)26(24-21)19-11-13-20(14-12-19)32(23,29)30/h2-14,22,25H,15H2,1H3,(H2,23,29,30)
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Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222102
PNG
(1-(4-Aminosulfonylphenyl)-5-(2-thienyl)-3-(4-metha...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=NN(C(C1)c1cccs1)c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C20H20N4O4S3/c1-30(25,26)23-15-6-4-14(5-7-15)18-13-19(20-3-2-12-29-20)24(22-18)16-8-10-17(11-9-16)31(21,27)28/h2-12,19,23H,13H2,1H3,(H2,21,27,28)
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n/an/a 7.80E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM181101
PNG
(N-(3,4,5-trimethoxybenzylidene)-2-(3,6-dimethyl-1-...)
Show SMILES COc1cc(\C=N\NC(=O)COc2cc(C)nc3n(nc(C)c23)-c2ccccc2)cc(OC)c1OC
Show InChI InChI=1S/C26H27N5O5/c1-16-11-20(24-17(2)30-31(26(24)28-16)19-9-7-6-8-10-19)36-15-23(32)29-27-14-18-12-21(33-3)25(35-5)22(13-18)34-4/h6-14H,15H2,1-5H3,(H,29,32)/b27-14+
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PubMed
n/an/a 8.20E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
Kinase activity was determined using Kinase-Glo Plus luminescence kinase assay kit according to the manufacturer instructions. The assays depend on t...


Bioorg Chem 66: 88-96 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.011
BindingDB Entry DOI: 10.7270/Q2VQ31GF
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor


(Homo sapiens (human))
BDBM181101
PNG
(N-(3,4,5-trimethoxybenzylidene)-2-(3,6-dimethyl-1-...)
Show SMILES COc1cc(\C=N\NC(=O)COc2cc(C)nc3n(nc(C)c23)-c2ccccc2)cc(OC)c1OC
Show InChI InChI=1S/C26H27N5O5/c1-16-11-20(24-17(2)30-31(26(24)28-16)19-9-7-6-8-10-19)36-15-23(32)29-27-14-18-12-21(33-3)25(35-5)22(13-18)34-4/h6-14H,15H2,1-5H3,(H,29,32)/b27-14+
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PubMed
n/an/a 8.37E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
Kinase activity was determined using Kinase-Glo Plus luminescence kinase assay kit according to the manufacturer instructions. The assays depend on t...


Bioorg Chem 66: 88-96 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.011
BindingDB Entry DOI: 10.7270/Q2VQ31GF
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222092
PNG
(6-(4-Methanesulfonylaminophenyl)-2-oxo-4-(4-tolyl)...)
Show SMILES Cc1ccc(cc1)-c1cc([nH]c(=O)c1C#N)-c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C20H17N3O3S/c1-13-3-5-14(6-4-13)17-11-19(22-20(24)18(17)12-21)15-7-9-16(10-8-15)23-27(2,25)26/h3-11,23H,1-2H3,(H,22,24)
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n/an/a 8.60E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Cyclooxygenase-2 (COX-2)


(Homo sapiens (Human))
BDBM175283
PNG
(3-(4-Aminosulfonylphenylamino)-5-methyl-2-phenyl-4...)
Show SMILES CC1SC(N(Nc2ccc(cc2)S(N)(=O)=O)C1=O)c1ccccc1
Show InChI InChI=1S/C16H17N3O3S2/c1-11-15(20)19(16(23-11)12-5-3-2-4-6-12)18-13-7-9-14(10-8-13)24(17,21)22/h2-11,16,18H,1H3,(H2,17,21,22)
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n/an/a 8.70E+3n/an/an/an/an/an/a



Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222083
PNG
(4-(2-Furyl)-6-(4-nitrophenyl)-2-oxo-1,2-dihydropyr...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(-c2ccco2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C16H9N3O4/c17-9-13-12(15-2-1-7-23-15)8-14(18-16(13)20)10-3-5-11(6-4-10)19(21)22/h1-8H,(H,18,20)
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n/an/a 8.90E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222091
PNG
(6-(4-Methanesulfonylaminophenyl)-2-oxo-4-phenyl-1,...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1cc(-c2ccccc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C19H15N3O3S/c1-26(24,25)22-15-9-7-14(8-10-15)18-11-16(13-5-3-2-4-6-13)17(12-20)19(23)21-18/h2-11,22H,1H3,(H,21,23)
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n/an/a 9.40E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (human))
BDBM181098
PNG
(N-(4-chlorobenzylidene)-2-(3,6-dimethyl-1-phenyl-1...)
Show SMILES Cc1nn(-c2ccccc2)c2nc(C)cc(OCC(=O)N\N=C\c3ccc(Cl)cc3)c12
Show InChI InChI=1S/C23H20ClN5O2/c1-15-12-20(31-14-21(30)27-25-13-17-8-10-18(24)11-9-17)22-16(2)28-29(23(22)26-15)19-6-4-3-5-7-19/h3-13H,14H2,1-2H3,(H,27,30)/b25-13+
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n/an/a 9.59E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
Kinase activity was determined using Kinase-Glo Plus luminescence kinase assay kit according to the manufacturer instructions. The assays depend on t...


Bioorg Chem 66: 88-96 (2016)


Article DOI: 10.1016/j.bioorg.2016.03.011
BindingDB Entry DOI: 10.7270/Q2VQ31GF
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222099
PNG
(1-(4-Aminosulfonylphenyl)-5-(4-chlorophenyl)-3-(4-...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C1=NN(C(C1)c1ccc(Cl)cc1)c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C22H21ClN4O4S2/c1-32(28,29)26-18-8-4-15(5-9-18)21-14-22(16-2-6-17(23)7-3-16)27(25-21)19-10-12-20(13-11-19)33(24,30)31/h2-13,22,26H,14H2,1H3,(H2,24,30,31)
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n/an/a 9.70E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM11639
PNG
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
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n/an/a 9.70E+3n/an/an/an/an/an/a



Beni Suef University



Assay Description
The ability of the tested compounds to inhibit both COX-1 and COX-2 isozymes was measured using colorimetric COX (ovine) Inhibitor Screening Assay Ki...


Bioorg Chem 64: 1-12 (2016)


Article DOI: 10.1016/j.bioorg.2015.11.001
BindingDB Entry DOI: 10.7270/Q24M939R
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM11639
PNG
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
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n/an/a 9.70E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222095
PNG
(4-(2-Furyl)-6-(4-methanesulfonylaminophenyl)-2-oxo...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1cc(-c2ccco2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C17H13N3O4S/c1-25(22,23)20-12-6-4-11(5-7-12)15-9-13(16-3-2-8-24-16)14(10-18)17(21)19-15/h2-9,20H,1H3,(H,19,21)
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n/an/a 9.80E+3n/an/an/an/an/an/a



Fayoum University



Assay Description
The ability of the tested compounds to inhibit both isozymes, COX-1 and COX-2 was measured using colorimetric COX (ovine) Inhibitor Screening Assay K...


Bioorg Chem 70: 173-183 (2017)


Article DOI: 10.1016/j.bioorg.2016.12.008
BindingDB Entry DOI: 10.7270/Q208645J
More data for this
Ligand-Target Pair
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