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PubMed code 27894776

Compile data set for download or QSAR
Found 26 hits of Enzyme Inhibition Constant Data   
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))
BDBM221998
PNG
(4-[3-(4-Chloro-phenyl)-5-(3,4,5-trimethoxy-phenyl)...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H24ClN3O5S/c1-31-22-12-16(13-23(32-2)24(22)33-3)21-14-20(15-4-6-17(25)7-5-15)27-28(21)18-8-10-19(11-9-18)34(26,29)30/h4-13,21H,14H2,1-3H3,(H2,26,29,30)
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n/an/a 220n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222002
PNG
(3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-1-(4-methan...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H25ClN2O5S/c1-31-23-13-17(14-24(32-2)25(23)33-3)22-15-21(16-5-7-18(26)8-6-16)27-28(22)19-9-11-20(12-10-19)34(4,29)30/h5-14,22H,15H2,1-4H3
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n/an/a 420n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM54643
PNG
(4-[3-(4-Bromo-phenyl)-5-(4-methoxy-phenyl)-4,5-dih...)
Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccc(Br)cc1
Show InChI InChI=1S/C22H20BrN3O3S/c1-29-19-10-4-16(5-11-19)22-14-21(15-2-6-17(23)7-3-15)25-26(22)18-8-12-20(13-9-18)30(24,27)28/h2-13,22H,14H2,1H3,(H2,24,27,28)
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n/an/a 630n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222005
PNG
(3-(4-Bromo-phenyl)-1-(4-methanesulfonyl-phenyl)-5-...)
Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Br)cc1
Show InChI InChI=1S/C23H21BrN2O3S/c1-29-20-11-5-17(6-12-20)23-15-22(16-3-7-18(24)8-4-16)25-26(23)19-9-13-21(14-10-19)30(2,27)28/h3-14,23H,15H2,1-2H3
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Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM54640
PNG
(4-[3-(4-Chloro-phenyl)-5-(4-methoxy-phenyl)-4,5-di...)
Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H20ClN3O3S/c1-29-19-10-4-16(5-11-19)22-14-21(15-2-6-17(23)7-3-15)25-26(22)18-8-12-20(13-9-18)30(24,27)28/h2-13,22H,14H2,1H3,(H2,24,27,28)
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n/an/a 740n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM221997
PNG
(4-[3-(4-Bromo-phenyl)-5-(3,4,5-trimethoxy-phenyl)-...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccc(Br)cc1
Show InChI InChI=1S/C24H24BrN3O5S/c1-31-22-12-16(13-23(32-2)24(22)33-3)21-14-20(15-4-6-17(25)7-5-15)27-28(21)18-8-10-19(11-9-18)34(26,29)30/h4-13,21H,14H2,1-3H3,(H2,26,29,30)
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n/an/a 780n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
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 840n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222000
PNG
(4-[3-(4-Chloro-phenyl)-5-(4-chloro-phenyl)-4,5-dih...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H17Cl2N3O2S/c22-16-5-1-14(2-6-16)20-13-21(15-3-7-17(23)8-4-15)26(25-20)18-9-11-19(12-10-18)29(24,27)28/h1-12,21H,13H2,(H2,24,27,28)
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n/an/a 900n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222001
PNG
(3-(4-Bromo-phenyl)-1-(4-methanesulfonyl-phenyl)-5-...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Br)cc1
Show InChI InChI=1S/C25H25BrN2O5S/c1-31-23-13-17(14-24(32-2)25(23)33-3)22-15-21(16-5-7-18(26)8-6-16)27-28(22)19-9-11-20(12-10-19)34(4,29)30/h5-14,22H,15H2,1-4H3
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n/an/a 980n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM221999
PNG
(4-[3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-4,5-dihy...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc(Cl)cc1)c1ccc(Br)cc1
Show InChI InChI=1S/C21H17BrClN3O2S/c22-16-5-1-14(2-6-16)20-13-21(15-3-7-17(23)8-4-15)26(25-20)18-9-11-19(12-10-18)29(24,27)28/h1-12,21H,13H2,(H2,24,27,28)
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n/an/a 1.43E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222004
PNG
(3,5-Bis-(4-chloro-phenyl)-1-(4-methanesulfonyl-phe...)
Show SMILES CS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H18Cl2N2O2S/c1-29(27,28)20-12-10-19(11-13-20)26-22(16-4-8-18(24)9-5-16)14-21(25-26)15-2-6-17(23)7-3-15/h2-13,22H,14H2,1H3
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Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222002
PNG
(3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-1-(4-methan...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H25ClN2O5S/c1-31-23-13-17(14-24(32-2)25(23)33-3)22-15-21(16-5-7-18(26)8-6-16)27-28(22)19-9-11-20(12-10-19)34(4,29)30/h5-14,22H,15H2,1-4H3
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n/an/a 2.98E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (Cyclooxygenase-2)


(Ovis aries (Sheep))
BDBM222006
PNG
(3-(4-Chloro-phenyl)-1-(4-methanesulfonyl-phenyl)-5...)
Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H21ClN2O3S/c1-29-20-11-5-17(6-12-20)23-15-22(16-3-7-18(24)8-4-16)25-26(23)19-9-13-21(14-10-19)30(2,27)28/h3-14,23H,15H2,1-2H3
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n/an/a 3.41E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM221998
PNG
(4-[3-(4-Chloro-phenyl)-5-(3,4,5-trimethoxy-phenyl)...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C24H24ClN3O5S/c1-31-22-12-16(13-23(32-2)24(22)33-3)21-14-20(15-4-6-17(25)7-5-15)27-28(21)18-8-10-19(11-9-18)34(26,29)30/h4-13,21H,14H2,1-3H3,(H2,26,29,30)
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Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222002
PNG
(3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-1-(4-methan...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H25ClN2O5S/c1-31-23-13-17(14-24(32-2)25(23)33-3)22-15-21(16-5-7-18(26)8-6-16)27-28(22)19-9-11-20(12-10-19)34(4,29)30/h5-14,22H,15H2,1-4H3
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n/an/a 3.87E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222005
PNG
(3-(4-Bromo-phenyl)-1-(4-methanesulfonyl-phenyl)-5-...)
Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Br)cc1
Show InChI InChI=1S/C23H21BrN2O3S/c1-29-20-11-5-17(6-12-20)23-15-22(16-3-7-18(24)8-4-16)25-26(23)19-9-13-21(14-10-19)30(2,27)28/h3-14,23H,15H2,1-2H3
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n/an/a 4.85E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222000
PNG
(4-[3-(4-Chloro-phenyl)-5-(4-chloro-phenyl)-4,5-dih...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H17Cl2N3O2S/c22-16-5-1-14(2-6-16)20-13-21(15-3-7-17(23)8-4-15)26(25-20)18-9-11-19(12-10-18)29(24,27)28/h1-12,21H,13H2,(H2,24,27,28)
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n/an/a 5.11E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM54643
PNG
(4-[3-(4-Bromo-phenyl)-5-(4-methoxy-phenyl)-4,5-dih...)
Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccc(Br)cc1
Show InChI InChI=1S/C22H20BrN3O3S/c1-29-19-10-4-16(5-11-19)22-14-21(15-2-6-17(23)7-3-15)25-26(22)18-8-12-20(13-9-18)30(24,27)28/h2-13,22H,14H2,1H3,(H2,24,27,28)
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n/an/a 5.17E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM54640
PNG
(4-[3-(4-Chloro-phenyl)-5-(4-methoxy-phenyl)-4,5-di...)
Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H20ClN3O3S/c1-29-19-10-4-16(5-11-19)22-14-21(15-2-6-17(23)7-3-15)25-26(22)18-8-12-20(13-9-18)30(24,27)28/h2-13,22H,14H2,1H3,(H2,24,27,28)
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n/an/a 6.52E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM221999
PNG
(4-[3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-4,5-dihy...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc(Cl)cc1)c1ccc(Br)cc1
Show InChI InChI=1S/C21H17BrClN3O2S/c22-16-5-1-14(2-6-16)20-13-21(15-3-7-17(23)8-4-15)26(25-20)18-9-11-19(12-10-18)29(24,27)28/h1-12,21H,13H2,(H2,24,27,28)
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n/an/a 6.87E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
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 7.23E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM221997
PNG
(4-[3-(4-Bromo-phenyl)-5-(3,4,5-trimethoxy-phenyl)-...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(N)(=O)=O)c1ccc(Br)cc1
Show InChI InChI=1S/C24H24BrN3O5S/c1-31-22-12-16(13-23(32-2)24(22)33-3)21-14-20(15-4-6-17(25)7-5-15)27-28(21)18-8-10-19(11-9-18)34(26,29)30/h4-13,21H,14H2,1-3H3,(H2,26,29,30)
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n/an/a 7.52E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222002
PNG
(3-(4-Bromo-phenyl)-5-(4-chloro-phenyl)-1-(4-methan...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H25ClN2O5S/c1-31-23-13-17(14-24(32-2)25(23)33-3)22-15-21(16-5-7-18(26)8-6-16)27-28(22)19-9-11-20(12-10-19)34(4,29)30/h5-14,22H,15H2,1-4H3
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n/an/a 8.34E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222001
PNG
(3-(4-Bromo-phenyl)-1-(4-methanesulfonyl-phenyl)-5-...)
Show SMILES COc1cc(cc(OC)c1OC)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Br)cc1
Show InChI InChI=1S/C25H25BrN2O5S/c1-31-23-13-17(14-24(32-2)25(23)33-3)22-15-21(16-5-7-18(26)8-6-16)27-28(22)19-9-11-20(12-10-19)34(4,29)30/h5-14,22H,15H2,1-4H3
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n/an/a 8.65E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222004
PNG
(3,5-Bis-(4-chloro-phenyl)-1-(4-methanesulfonyl-phe...)
Show SMILES CS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc(Cl)cc1)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H18Cl2N2O2S/c1-29(27,28)20-12-10-19(11-13-20)26-22(16-4-8-18(24)9-5-16)14-21(25-26)15-2-6-17(23)7-3-15/h2-13,22H,14H2,1H3
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n/an/a 9.89E+3n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM222006
PNG
(3-(4-Chloro-phenyl)-1-(4-methanesulfonyl-phenyl)-5...)
Show SMILES COc1ccc(cc1)C1CC(=NN1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C23H21ClN2O3S/c1-29-20-11-5-17(6-12-20)23-15-22(16-3-7-18(24)8-4-16)25-26(23)19-9-13-21(14-10-19)30(2,27)28/h3-14,23H,15H2,1-2H3
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n/an/a 1.02E+4n/an/an/an/an/an/a



Beni-Suef University



Assay Description
The in vitro inhibition of ovine COX-1 and COX-2 was measured using an enzyme immuno assay (EIA) kit (Cayman Chemical, Ann Arbor, MI, USA) according ...


Bioorg Chem 70: 57-66 (2017)


Article DOI: 10.1016/j.bioorg.2016.11.008
BindingDB Entry DOI: 10.7270/Q2WH2NVP
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%