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Compile Data Set for Download or QSAR

Found 82 hits Enz. Inhib. hit(s) with all data for entry = 50013029   
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 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 2n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM22369
PNG
(4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofu...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1 |t:11|
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
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n/an/a 20n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase 1


(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 50n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125628
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-5...)
Show SMILES COC1(C)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:7|
Show InChI InChI=1S/C19H17FO5S/c1-19(24-2)17(13-6-10-15(11-7-13)26(3,22)23)16(18(21)25-19)12-4-8-14(20)9-5-12/h4-11H,1-3H3
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n/an/a 69n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125613
PNG
(3-(3,4-Dichloro-phenyl)-5-hydroxy-4-(4-methanesulf...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)c(Cl)c1 |c:6|
Show InChI InChI=1S/C18H14Cl2O5S/c1-18(22)16(10-3-6-12(7-4-10)26(2,23)24)15(17(21)25-18)11-5-8-13(19)14(20)9-11/h3-9,22H,1-2H3
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n/an/a 70n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125628
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-5...)
Show SMILES COC1(C)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:7|
Show InChI InChI=1S/C19H17FO5S/c1-19(24-2)17(13-6-10-15(11-7-13)26(3,22)23)16(18(21)25-19)12-4-8-14(20)9-5-12/h4-11H,1-3H3
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n/an/a 100n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Cyclooxygenase-2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125618
PNG
(3-(3-Chloro-4-fluoro-phenyl)-5-hydroxy-4-(4-methan...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)c(Cl)c1 |c:6|
Show InChI InChI=1S/C18H14ClFO5S/c1-18(22)16(10-3-6-12(7-4-10)26(2,23)24)15(17(21)25-18)11-5-8-14(20)13(19)9-11/h3-9,22H,1-2H3
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n/an/a 110n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125624
PNG
(3-(4-Chloro-phenyl)-5-hydroxy-4-(4-methanesulfonyl...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1 |c:6|
Show InChI InChI=1S/C18H15ClO5S/c1-18(21)16(12-5-9-14(10-6-12)25(2,22)23)15(17(20)24-18)11-3-7-13(19)8-4-11/h3-10,21H,1-2H3
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n/an/a 110n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125630
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccsc1 |c:6|
Show InChI InChI=1S/C16H14O5S2/c1-16(18)14(10-3-5-12(6-4-10)23(2,19)20)13(15(17)21-16)11-7-8-22-9-11/h3-9,18H,1-2H3
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n/an/a 110n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in the sensitive U937 microsome assay


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125631
PNG
(3-(4-Bromo-phenyl)-5-hydroxy-4-(4-methanesulfonyl-...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(Br)cc1 |c:6|
Show InChI InChI=1S/C18H15BrO5S/c1-18(21)16(12-5-9-14(10-6-12)25(2,22)23)15(17(20)24-18)11-3-7-13(19)8-4-11/h3-10,21H,1-2H3
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n/an/a 140n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125626
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccccc1 |c:6|
Show InChI InChI=1S/C18H16O5S/c1-18(20)16(13-8-10-14(11-9-13)24(2,21)22)15(17(19)23-18)12-6-4-3-5-7-12/h3-11,20H,1-2H3
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n/an/a 160n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125627
PNG
(3-(3,4-Difluoro-phenyl)-5-hydroxy-4-(4-methanesulf...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)c(F)c1 |c:6|
Show InChI InChI=1S/C18H14F2O5S/c1-18(22)16(10-3-6-12(7-4-10)26(2,23)24)15(17(21)25-18)11-5-8-13(19)14(20)9-11/h3-9,22H,1-2H3
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n/an/a 200n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125622
PNG
(3-(3-Fluoro-phenyl)-5-hydroxy-4-(4-methanesulfonyl...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1cccc(F)c1 |c:6|
Show InChI InChI=1S/C18H15FO5S/c1-18(21)16(11-6-8-14(9-7-11)25(2,22)23)15(17(20)24-18)12-4-3-5-13(19)10-12/h3-10,21H,1-2H3
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n/an/a 250n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125621
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CSc1ccc(cc1)C1=C(c2ccc(cc2)S(C)(=O)=O)C(C)(O)OC1=O |c:9|
Show InChI InChI=1S/C19H18O5S2/c1-19(21)17(13-6-10-15(11-7-13)26(3,22)23)16(18(20)24-19)12-4-8-14(25-2)9-5-12/h4-11,21H,1-3H3
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n/an/a 310n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125611
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-5...)
Show SMILES CC1(OCC(F)(F)F)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:11|
Show InChI InChI=1S/C20H16F4O5S/c1-19(28-11-20(22,23)24)17(13-5-9-15(10-6-13)30(2,26)27)16(18(25)29-19)12-3-7-14(21)8-4-12/h3-10H,11H2,1-2H3
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n/an/a 320n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125612
PNG
(3-(4-Fluoro-phenyl)-5-hydroxy-4-(4-methanesulfonyl...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:6|
Show InChI InChI=1S/C18H15FO5S/c1-18(21)16(12-5-9-14(10-6-12)25(2,22)23)15(17(20)24-18)11-3-7-13(19)8-4-11/h3-10,21H,1-2H3
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n/an/a 380n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125611
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-5...)
Show SMILES CC1(OCC(F)(F)F)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:11|
Show InChI InChI=1S/C20H16F4O5S/c1-19(28-11-20(22,23)24)17(13-5-9-15(10-6-13)30(2,26)27)16(18(25)29-19)12-3-7-14(21)8-4-12/h3-10H,11H2,1-2H3
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n/an/a 400n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125615
PNG
(5-Hydroxy-3-(4-isopropyl-phenyl)-4-(4-methanesulfo...)
Show SMILES CC(C)c1ccc(cc1)C1=C(c2ccc(cc2)S(C)(=O)=O)C(C)(O)OC1=O |c:10|
Show InChI InChI=1S/C21H22O5S/c1-13(2)14-5-7-15(8-6-14)18-19(21(3,23)26-20(18)22)16-9-11-17(12-10-16)27(4,24)25/h5-13,23H,1-4H3
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n/an/a 410n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125620
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc2ccccc2c1 |c:6|
Show InChI InChI=1S/C22H18O5S/c1-22(24)20(15-9-11-18(12-10-15)28(2,25)26)19(21(23)27-22)17-8-7-14-5-3-4-6-16(14)13-17/h3-13,24H,1-2H3
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n/an/a 450n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125619
PNG
(5-Ethoxy-3-(4-fluoro-phenyl)-4-(4-methanesulfonyl-...)
Show SMILES CCOC1(C)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:8|
Show InChI InChI=1S/C20H19FO5S/c1-4-25-20(2)18(14-7-11-16(12-8-14)27(3,23)24)17(19(22)26-20)13-5-9-15(21)10-6-13/h5-12H,4H2,1-3H3
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n/an/a 500n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM22369
PNG
(4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofu...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1 |t:11|
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
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n/an/a 500n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125609
PNG
(3-(3,5-Difluoro-phenyl)-5-hydroxy-4-(4-methanesulf...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1cc(F)cc(F)c1 |c:6|
Show InChI InChI=1S/C18H14F2O5S/c1-18(22)16(10-3-5-14(6-4-10)26(2,23)24)15(17(21)25-18)11-7-12(19)9-13(20)8-11/h3-9,22H,1-2H3
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n/an/a 550n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125623
PNG
(3-Benzo[b]thiophen-2-yl-5-hydroxy-4-(4-methanesulf...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1cc2ccccc2s1 |c:6|
Show InChI InChI=1S/C20H16O5S2/c1-20(22)18(12-7-9-14(10-8-12)27(2,23)24)17(19(21)25-20)16-11-13-5-3-4-6-15(13)26-16/h3-11,22H,1-2H3
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n/an/a 650n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125610
PNG
(3-(4-Fluoro-phenyl)-5-isopropoxy-4-(4-methanesulfo...)
Show SMILES CC(C)OC1(C)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:9|
Show InChI InChI=1S/C21H21FO5S/c1-13(2)26-21(3)19(15-7-11-17(12-8-15)28(4,24)25)18(20(23)27-21)14-5-9-16(22)10-6-14/h5-13H,1-4H3
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n/an/a 800n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125613
PNG
(3-(3,4-Dichloro-phenyl)-5-hydroxy-4-(4-methanesulf...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)c(Cl)c1 |c:6|
Show InChI InChI=1S/C18H14Cl2O5S/c1-18(22)16(10-3-6-12(7-4-10)26(2,23)24)15(17(21)25-18)11-5-8-13(19)14(20)9-11/h3-9,22H,1-2H3
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n/an/a 850n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 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 1.00E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Cyclooxygenase-2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125617
PNG
(3-(2,4-Dichloro-phenyl)-5-hydroxy-4-(4-methanesulf...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1Cl |c:6|
Show InChI InChI=1S/C18H14Cl2O5S/c1-18(22)16(10-3-6-12(7-4-10)26(2,23)24)15(17(21)25-18)13-8-5-11(19)9-14(13)20/h3-9,22H,1-2H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125626
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccccc1 |c:6|
Show InChI InChI=1S/C18H16O5S/c1-18(20)16(13-8-10-14(11-9-13)24(2,21)22)15(17(19)23-18)12-6-4-3-5-7-12/h3-11,20H,1-2H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM22369
PNG
(4-(4-methanesulfonylphenyl)-3-phenyl-2,5-dihydrofu...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)OC1)c1ccccc1 |t:11|
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
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n/an/a 1.70E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in the sensitive U937 microsome assay


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125631
PNG
(3-(4-Bromo-phenyl)-5-hydroxy-4-(4-methanesulfonyl-...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(Br)cc1 |c:6|
Show InChI InChI=1S/C18H15BrO5S/c1-18(21)16(12-5-9-14(10-6-12)25(2,22)23)15(17(20)24-18)11-3-7-13(19)8-4-11/h3-10,21H,1-2H3
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n/an/a 1.70E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125621
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CSc1ccc(cc1)C1=C(c2ccc(cc2)S(C)(=O)=O)C(C)(O)OC1=O |c:9|
Show InChI InChI=1S/C19H18O5S2/c1-19(21)17(13-6-10-15(11-7-13)26(3,22)23)16(18(20)24-19)12-4-8-14(25-2)9-5-12/h4-11,21H,1-3H3
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n/an/a 1.70E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125624
PNG
(3-(4-Chloro-phenyl)-5-hydroxy-4-(4-methanesulfonyl...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1 |c:6|
Show InChI InChI=1S/C18H15ClO5S/c1-18(21)16(12-5-9-14(10-6-12)25(2,22)23)15(17(20)24-18)11-3-7-13(19)8-4-11/h3-10,21H,1-2H3
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n/an/a 1.70E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in the sensitive U937 microsome assay


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125612
PNG
(3-(4-Fluoro-phenyl)-5-hydroxy-4-(4-methanesulfonyl...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:6|
Show InChI InChI=1S/C18H15FO5S/c1-18(21)16(12-5-9-14(10-6-12)25(2,22)23)15(17(20)24-18)11-3-7-13(19)8-4-11/h3-10,21H,1-2H3
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n/an/a 1.80E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Cyclooxygenase-2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125614
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1cccs1 |c:6|
Show InChI InChI=1S/C16H14O5S2/c1-16(18)14(10-5-7-11(8-6-10)23(2,19)20)13(15(17)21-16)12-4-3-9-22-12/h3-9,18H,1-2H3
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n/an/a 1.90E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125618
PNG
(3-(3-Chloro-4-fluoro-phenyl)-5-hydroxy-4-(4-methan...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)c(Cl)c1 |c:6|
Show InChI InChI=1S/C18H14ClFO5S/c1-18(22)16(10-3-6-12(7-4-10)26(2,23)24)15(17(21)25-18)11-5-8-14(20)13(19)9-11/h3-9,22H,1-2H3
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n/an/a 2.20E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50125610
PNG
(3-(4-Fluoro-phenyl)-5-isopropoxy-4-(4-methanesulfo...)
Show SMILES CC(C)OC1(C)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:9|
Show InChI InChI=1S/C21H21FO5S/c1-13(2)26-21(3)19(15-7-11-17(12-8-15)28(4,24)25)18(20(23)27-21)14-5-9-16(22)10-6-14/h5-13H,1-4H3
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n/an/a 3.00E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in the sensitive U937 microsome assay


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125620
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc2ccccc2c1 |c:6|
Show InChI InChI=1S/C22H18O5S/c1-22(24)20(15-9-11-18(12-10-15)28(2,25)26)19(21(23)27-22)17-8-7-14-5-3-4-6-16(14)13-17/h3-13,24H,1-2H3
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n/an/a 3.20E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125623
PNG
(3-Benzo[b]thiophen-2-yl-5-hydroxy-4-(4-methanesulf...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1cc2ccccc2s1 |c:6|
Show InChI InChI=1S/C20H16O5S2/c1-20(22)18(12-7-9-14(10-8-12)27(2,23)24)17(19(21)25-20)16-11-13-5-3-4-6-15(13)26-16/h3-11,22H,1-2H3
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n/an/a 3.20E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory of human Prostaglandin G/H synthase 2 expressed in CHO cells.


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125615
PNG
(5-Hydroxy-3-(4-isopropyl-phenyl)-4-(4-methanesulfo...)
Show SMILES CC(C)c1ccc(cc1)C1=C(c2ccc(cc2)S(C)(=O)=O)C(C)(O)OC1=O |c:10|
Show InChI InChI=1S/C21H22O5S/c1-13(2)14-5-7-15(8-6-14)18-19(21(3,23)26-20(18)22)16-9-11-17(12-10-16)27(4,24)25/h5-13,23H,1-4H3
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n/an/a 4.30E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125625
PNG
(5-Hydroxy-3-(4-hydroxy-phenyl)-4-(4-methanesulfony...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(O)cc1 |c:6|
Show InChI InChI=1S/C18H16O6S/c1-18(21)16(12-5-9-14(10-6-12)25(2,22)23)15(17(20)24-18)11-3-7-13(19)8-4-11/h3-10,19,21H,1-2H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in the sensitive U937 microsome assay


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125616
PNG
(3-(3,4-Difluoro-phenoxy)-5-hydroxy-4-(4-methanesul...)
Show SMILES CC1(O)OC(=O)C(Oc2ccc(F)c(F)c2)=C1c1ccc(cc1)S(C)(=O)=O |c:16|
Show InChI InChI=1S/C18H14F2O6S/c1-18(22)15(10-3-6-12(7-4-10)27(2,23)24)16(17(21)26-18)25-11-5-8-13(19)14(20)9-11/h3-9,22H,1-2H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125629
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CC1(O)OC(=O)C(Sc2ccccc2)=C1c1ccc(cc1)S(C)(=O)=O |c:14|
Show InChI InChI=1S/C18H16O5S2/c1-18(20)15(12-8-10-14(11-9-12)25(2,21)22)16(17(19)23-18)24-13-6-4-3-5-7-13/h3-11,20H,1-2H3
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n/an/a>5.00E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125627
PNG
(3-(3,4-Difluoro-phenyl)-5-hydroxy-4-(4-methanesulf...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)c(F)c1 |c:6|
Show InChI InChI=1S/C18H14F2O5S/c1-18(22)16(10-3-6-12(7-4-10)26(2,23)24)15(17(21)25-18)11-5-8-13(19)14(20)9-11/h3-9,22H,1-2H3
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n/an/a 6.30E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(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 6.30E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50125621
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CSc1ccc(cc1)C1=C(c2ccc(cc2)S(C)(=O)=O)C(C)(O)OC1=O |c:9|
Show InChI InChI=1S/C19H18O5S2/c1-19(21)17(13-6-10-15(11-7-13)26(3,22)23)16(18(20)24-19)12-4-8-14(25-2)9-5-12/h4-11,21H,1-3H3
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n/an/a 7.00E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125617
PNG
(3-(2,4-Dichloro-phenyl)-5-hydroxy-4-(4-methanesulf...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(Cl)cc1Cl |c:6|
Show InChI InChI=1S/C18H14Cl2O5S/c1-18(22)16(10-3-6-12(7-4-10)26(2,23)24)15(17(21)25-18)13-8-5-11(19)9-14(13)20/h3-9,22H,1-2H3
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n/an/a 7.50E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50125611
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-5...)
Show SMILES CC1(OCC(F)(F)F)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(F)cc1 |c:11|
Show InChI InChI=1S/C20H16F4O5S/c1-19(28-11-20(22,23)24)17(13-5-9-15(10-6-13)30(2,26)27)16(18(25)29-19)12-3-7-14(21)8-4-12/h3-10H,11H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in the sensitive U937 microsome assay


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50125629
PNG
(5-Hydroxy-4-(4-methanesulfonyl-phenyl)-5-methyl-3-...)
Show SMILES CC1(O)OC(=O)C(Sc2ccccc2)=C1c1ccc(cc1)S(C)(=O)=O |c:14|
Show InChI InChI=1S/C18H16O5S2/c1-18(20)15(12-8-10-14(11-9-12)25(2,21)22)16(17(19)23-18)24-13-6-4-3-5-7-13/h3-11,20H,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 2 in human whole blood


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50125616
PNG
(3-(3,4-Difluoro-phenoxy)-5-hydroxy-4-(4-methanesul...)
Show SMILES CC1(O)OC(=O)C(Oc2ccc(F)c(F)c2)=C1c1ccc(cc1)S(C)(=O)=O |c:16|
Show InChI InChI=1S/C18H14F2O6S/c1-18(22)15(10-3-6-12(7-4-10)27(2,23)24)16(17(21)26-18)25-11-5-8-13(19)14(20)9-11/h3-9,22H,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in the sensitive U937 microsome assay


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50125625
PNG
(5-Hydroxy-3-(4-hydroxy-phenyl)-4-(4-methanesulfony...)
Show SMILES CC1(O)OC(=O)C(=C1c1ccc(cc1)S(C)(=O)=O)c1ccc(O)cc1 |c:6|
Show InChI InChI=1S/C18H16O6S/c1-18(21)16(12-5-9-14(10-6-12)25(2,22)23)15(17(20)24-18)11-3-7-13(19)8-4-11/h3-10,19,21H,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound was measured against Prostaglandin G/H synthase 1 in the sensitive U937 microsome assay


Bioorg Med Chem Lett 13: 1195-8 (2003)


BindingDB Entry DOI: 10.7270/Q2GT5MJR
More data for this
Ligand-Target Pair
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