BindingDB logo
myBDB logout

PubMed code 10937738

Compile data set for download or QSAR
Found 38 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 1


(Homo sapiens (Human))		BDBM17638
PNG
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)
Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1
Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
PubMed
n/an/a 190n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090629
PNG
(1-(2-Chloro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1ccccc1Cl)c1ccc(cc1)S(C)(=O)=O |t:9|
Show InChI InChI=1S/C24H20ClNO4S/c1-30-18-11-7-17(8-12-18)23-20(16-9-13-19(14-10-16)31(2,28)29)15-26(24(23)27)22-6-4-3-5-21(22)25/h3-14H,15H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 220n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090627
PNG
(4-(4-Methanesulfonyl-phenyl)-1,3-diphenyl-1,5-dihy...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1)c1ccccc1 |t:11|
Show InChI InChI=1S/C23H19NO3S/c1-28(26,27)20-14-12-17(13-15-20)21-16-24(19-10-6-3-7-11-19)23(25)22(21)18-8-4-2-5-9-18/h2-15H,16H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 280n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090626
PNG
(1-(3-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1cccc(F)c1)c1ccc(cc1)S(C)(=O)=O |t:9|
Show InChI InChI=1S/C24H20FNO4S/c1-30-20-10-6-17(7-11-20)23-22(16-8-12-21(13-9-16)31(2,28)29)15-26(24(23)27)19-5-3-4-18(25)14-19/h3-14H,15H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 280n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090633
PNG
(1-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |t:9|
Show InChI InChI=1S/C24H20FNO4S/c1-30-20-11-3-17(4-12-20)23-22(16-5-13-21(14-6-16)31(2,28)29)15-26(24(23)27)19-9-7-18(25)8-10-19/h3-14H,15H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 300n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090622
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1)c1ccc(F)cc1 |t:11|
Show InChI InChI=1S/C23H18FNO3S/c1-29(27,28)20-13-9-16(10-14-20)21-15-25(19-5-3-2-4-6-19)23(26)22(21)17-7-11-18(24)12-8-17/h2-14H,15H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 310n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090634
PNG
(3-(4-Fluoro-phenyl)-1-(2-fluoro-phenyl)-4-(4-metha...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1F)c1ccc(F)cc1 |t:11|
Show InChI InChI=1S/C23H17F2NO3S/c1-30(28,29)18-12-8-15(9-13-18)19-14-26(21-5-3-2-4-20(21)25)23(27)22(19)16-6-10-17(24)11-7-16/h2-13H,14H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 320n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090621
PNG
(4-(4-Methanesulfonyl-phenyl)-3-(4-methoxy-phenyl)-...)
Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1ccccc1)c1ccc(cc1)S(C)(=O)=O |t:9|
Show InChI InChI=1S/C24H21NO4S/c1-29-20-12-8-18(9-13-20)23-22(17-10-14-21(15-11-17)30(2,27)28)16-25(24(23)26)19-6-4-3-5-7-19/h3-15H,16H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 340n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090619
PNG
(1-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccc(F)cc1)c1ccccc1 |t:11|
Show InChI InChI=1S/C23H18FNO3S/c1-29(27,28)20-13-7-16(8-14-20)21-15-25(19-11-9-18(24)10-12-19)23(26)22(21)17-5-3-2-4-6-17/h2-14H,15H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 350n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM17638
PNG
(2-{1-[(4-chlorophenyl)carbonyl]-5-methoxy-2-methyl...)
Show SMILES COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1
Show InChI InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
DrugBank
PDB
PubMed
n/an/a 410n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
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)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
DrugBank
PDB
PubMed
n/an/a 530n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090624
PNG
(1-(2-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1F)c1ccccc1 |t:11|
Show InChI InChI=1S/C23H18FNO3S/c1-29(27,28)18-13-11-16(12-14-18)19-15-25(21-10-6-5-9-20(21)24)23(26)22(19)17-7-3-2-4-8-17/h2-14H,15H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 900n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090628
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccc(cc1)C(F)(F)F)c1ccc(F)cc1 |t:11|
Show InChI InChI=1S/C24H17F4NO3S/c1-33(31,32)20-12-4-15(5-13-20)21-14-29(19-10-6-17(7-11-19)24(26,27)28)23(30)22(21)16-2-8-18(25)9-3-16/h2-13H,14H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 950n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090620
PNG
(4-(4-Methanesulfonyl-phenyl)-3-phenyl-1-(4-trifluo...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccc(cc1)C(F)(F)F)c1ccccc1 |t:11|
Show InChI InChI=1S/C24H18F3NO3S/c1-32(30,31)20-13-7-16(8-14-20)21-15-28(19-11-9-18(10-12-19)24(25,26)27)23(29)22(21)17-5-3-2-4-6-17/h2-14H,15H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 980n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090632
PNG
(4-(4-Methanesulfonyl-phenyl)-3-phenyl-1-p-tolyl-1,...)
Show SMILES Cc1ccc(cc1)N1CC(=C(C1=O)c1ccccc1)c1ccc(cc1)S(C)(=O)=O |c:10|
Show InChI InChI=1S/C24H21NO3S/c1-17-8-12-20(13-9-17)25-16-22(18-10-14-21(15-11-18)29(2,27)28)23(24(25)26)19-6-4-3-5-7-19/h3-15H,16H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090630
PNG
(1-(3-Chloro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1cccc(Cl)c1)c1ccccc1 |t:11|
Show InChI InChI=1S/C23H18ClNO3S/c1-29(27,28)20-12-10-16(11-13-20)21-15-25(19-9-5-8-18(24)14-19)23(26)22(21)17-6-3-2-4-7-17/h2-14H,15H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090625
PNG
(3-(3,4-Difluoro-phenyl)-4-(4-methanesulfonyl-pheny...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1)c1ccc(F)c(F)c1 |t:11|
Show InChI InChI=1S/C23H17F2NO3S/c1-30(28,29)18-10-7-15(8-11-18)19-14-26(17-5-3-2-4-6-17)23(27)22(19)16-9-12-20(24)21(25)13-16/h2-13H,14H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090635
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES COc1ccccc1N1CC(=C(C1=O)c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |c:11|
Show InChI InChI=1S/C24H20FNO4S/c1-30-22-6-4-3-5-21(22)26-15-20(16-9-13-19(14-10-16)31(2,28)29)23(24(26)27)17-7-11-18(25)12-8-17/h3-14H,15H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
PubMed
n/an/a 1.05E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090623
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES Cc1ccc(cc1)N1CC(=C(C1=O)c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |c:10|
Show InChI InChI=1S/C24H20FNO3S/c1-16-3-11-20(12-4-16)26-15-22(17-7-13-21(14-8-17)30(2,28)29)23(24(26)27)18-5-9-19(25)10-6-18/h3-14H,15H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Similars
PubMed
n/an/a 1.05E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))		BDBM50090631
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES COc1ccc(cc1)N1CC(=C(C1=O)c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |c:11|
Show InChI InChI=1S/C24H20FNO4S/c1-30-20-11-9-19(10-12-20)26-15-22(16-5-13-21(14-6-16)31(2,28)29)23(24(26)27)17-3-7-18(25)8-4-17/h3-14H,15H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 2 measured as, PGE-2 levels in lipopolysaccharide (LPS)-challenged human whole blood

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090629
PNG
(1-(2-Chloro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1ccccc1Cl)c1ccc(cc1)S(C)(=O)=O |t:9|
Show InChI InChI=1S/C24H20ClNO4S/c1-30-18-11-7-17(8-12-18)23-20(16-9-13-19(14-10-16)31(2,28)29)15-26(24(23)27)22-6-4-3-5-21(22)25/h3-14H,15H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 2.30E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090627
PNG
(4-(4-Methanesulfonyl-phenyl)-1,3-diphenyl-1,5-dihy...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1)c1ccccc1 |t:11|
Show InChI InChI=1S/C23H19NO3S/c1-28(26,27)20-14-12-17(13-15-20)21-16-24(19-10-6-3-7-11-19)23(25)22(21)18-8-4-2-5-9-18/h2-15H,16H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 2.40E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090626
PNG
(1-(3-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1cccc(F)c1)c1ccc(cc1)S(C)(=O)=O |t:9|
Show InChI InChI=1S/C24H20FNO4S/c1-30-20-10-6-17(7-11-20)23-22(16-8-12-21(13-9-16)31(2,28)29)15-26(24(23)27)19-5-3-4-18(25)14-19/h3-14H,15H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

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



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090634
PNG
(3-(4-Fluoro-phenyl)-1-(2-fluoro-phenyl)-4-(4-metha...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1F)c1ccc(F)cc1 |t:11|
Show InChI InChI=1S/C23H17F2NO3S/c1-30(28,29)18-12-8-15(9-13-18)19-14-26(21-5-3-2-4-20(21)25)23(27)22(19)16-6-10-17(24)11-7-16/h2-13H,14H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

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



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090633
PNG
(1-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |t:9|
Show InChI InChI=1S/C24H20FNO4S/c1-30-20-11-3-17(4-12-20)23-22(16-5-13-21(14-6-16)31(2,28)29)15-26(24(23)27)19-9-7-18(25)8-10-19/h3-14H,15H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

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



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090621
PNG
(4-(4-Methanesulfonyl-phenyl)-3-(4-methoxy-phenyl)-...)
Show SMILES COc1ccc(cc1)C1=C(CN(C1=O)c1ccccc1)c1ccc(cc1)S(C)(=O)=O |t:9|
Show InChI InChI=1S/C24H21NO4S/c1-29-20-12-8-18(9-13-20)23-22(17-10-14-21(15-11-17)30(2,27)28)16-25(24(23)26)19-6-4-3-5-7-19/h3-15H,16H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 2.68E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090622
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1)c1ccc(F)cc1 |t:11|
Show InChI InChI=1S/C23H18FNO3S/c1-29(27,28)20-13-9-16(10-14-20)21-15-25(19-5-3-2-4-6-19)23(26)22(21)17-7-11-18(24)12-8-17/h2-14H,15H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 2.70E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090623
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES Cc1ccc(cc1)N1CC(=C(C1=O)c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |c:10|
Show InChI InChI=1S/C24H20FNO3S/c1-16-3-11-20(12-4-16)26-15-22(17-7-13-21(14-8-17)30(2,28)29)23(24(26)27)18-5-9-19(25)10-6-18/h3-14H,15H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 3.70E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090635
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES COc1ccccc1N1CC(=C(C1=O)c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |c:11|
Show InChI InChI=1S/C24H20FNO4S/c1-30-22-6-4-3-5-21(22)26-15-20(16-9-13-19(14-10-16)31(2,28)29)23(24(26)27)17-7-11-18(25)12-8-17/h3-14H,15H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 4.00E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090620
PNG
(4-(4-Methanesulfonyl-phenyl)-3-phenyl-1-(4-trifluo...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccc(cc1)C(F)(F)F)c1ccccc1 |t:11|
Show InChI InChI=1S/C24H18F3NO3S/c1-32(30,31)20-13-7-16(8-14-20)21-15-28(19-11-9-18(10-12-19)24(25,26)27)23(29)22(21)17-5-3-2-4-6-17/h2-14H,15H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 5.10E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090631
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES COc1ccc(cc1)N1CC(=C(C1=O)c1ccc(F)cc1)c1ccc(cc1)S(C)(=O)=O |c:11|
Show InChI InChI=1S/C24H20FNO4S/c1-30-20-11-9-19(10-12-20)26-15-22(16-5-13-21(14-6-16)31(2,28)29)23(24(26)27)17-3-7-18(25)8-4-17/h3-14H,15H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 5.28E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090619
PNG
(1-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccc(F)cc1)c1ccccc1 |t:11|
Show InChI InChI=1S/C23H18FNO3S/c1-29(27,28)20-13-7-16(8-14-20)21-15-25(19-11-9-18(24)10-12-19)23(26)22(21)17-5-3-2-4-6-17/h2-14H,15H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 5.86E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090632
PNG
(4-(4-Methanesulfonyl-phenyl)-3-phenyl-1-p-tolyl-1,...)
Show SMILES Cc1ccc(cc1)N1CC(=C(C1=O)c1ccccc1)c1ccc(cc1)S(C)(=O)=O |c:10|
Show InChI InChI=1S/C24H21NO3S/c1-17-8-12-20(13-9-17)25-16-22(18-10-14-21(15-11-18)29(2,27)28)23(24(25)26)19-6-4-3-5-7-19/h3-15H,16H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 6.90E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090628
PNG
(3-(4-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-1...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccc(cc1)C(F)(F)F)c1ccc(F)cc1 |t:11|
Show InChI InChI=1S/C24H17F4NO3S/c1-33(31,32)20-12-4-15(5-13-20)21-14-29(19-10-6-17(7-11-19)24(26,27)28)23(30)22(21)16-2-8-18(25)9-3-16/h2-13H,14H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 7.20E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090625
PNG
(3-(3,4-Difluoro-phenyl)-4-(4-methanesulfonyl-pheny...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1)c1ccc(F)c(F)c1 |t:11|
Show InChI InChI=1S/C23H17F2NO3S/c1-30(28,29)18-10-7-15(8-11-18)19-14-26(17-5-3-2-4-6-17)23(27)22(19)16-9-12-20(24)21(25)13-16/h2-13H,14H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 8.20E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
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)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
PubMed
n/an/a 9.73E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090630
PNG
(1-(3-Chloro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1cccc(Cl)c1)c1ccccc1 |t:11|
Show InChI InChI=1S/C23H18ClNO3S/c1-29(27,28)20-12-10-16(11-13-20)21-15-25(19-9-5-8-18(24)14-19)23(26)22(21)17-6-3-2-4-7-17/h2-14H,15H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 9.80E+3n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))		BDBM50090624
PNG
(1-(2-Fluoro-phenyl)-4-(4-methanesulfonyl-phenyl)-3...)
Show SMILES CS(=O)(=O)c1ccc(cc1)C1=C(C(=O)N(C1)c1ccccc1F)c1ccccc1 |t:11|
Show InChI InChI=1S/C23H18FNO3S/c1-29(27,28)18-13-11-16(12-14-18)19-15-25(21-10-6-5-9-20(21)24)23(26)22(19)17-7-3-2-4-8-17/h2-14H,15H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
PubMed
n/an/a 1.08E+4n/an/an/an/an/an/a



University of Barcelona

Curated by ChEMBL


Assay Description
Biochemical index for Prostaglandin G/H synthase 1 measured as, tromboxane 2 (TXB2) levels following blood coagulation

Bioorg Med Chem Lett 10: 1745-8 (2000)


BindingDB Entry DOI: 10.7270/Q2ZG6RH7
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%