Compile Data Set for Download or QSAR

Found 37 hits with Last Name = 'hüfner' and Initial = 'a'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50295926 (4'-O-methylhonokiol, MH | 4-methoxyhonokiol | ...) Show SMILES COc1ccc(cc1CC=C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C19H20O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h4-5,8-13,20H,1-2,6-7H2,3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM50295926 (4'-O-methylhonokiol, MH | 4-methoxyhonokiol | ...) Show SMILES COc1ccc(cc1CC=C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C19H20O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h4-5,8-13,20H,1-2,6-7H2,3H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50295923 (4'-Methoxy-3'-(E)-propenyl)-5-(2-propenyl)-bipheny...) Show SMILES COc1ccc(cc1\C=C\C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C19H20O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h4-5,7-13,20H,1,6H2,2-3H3/b7-5+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM50295925 ((E)-3'-Propenyl)-5-(2-propenyl)-biphenyl-2,4'-diol...) Show SMILES C\C=C\c1cc(ccc1O)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,6-12,19-20H,1,5H2,2H3/b6-4+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM50295923 (4'-Methoxy-3'-(E)-propenyl)-5-(2-propenyl)-bipheny...) Show SMILES COc1ccc(cc1\C=C\C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C19H20O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h4-5,7-13,20H,1,6H2,2-3H3/b7-5+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM50157312 (5,3''-Dipropyl-biphenyl-2,4''-diol | 5,3'-Dipropyl...) Show SMILES CCCc1ccc(O)c(c1)-c1ccc(O)c(CCC)c1 Show InChI InChI=1S/C18H22O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h7-12,19-20H,3-6H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	800	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50295924 (4'-Methoxy-3'-(Z)-propenyl)-5-(2-propenyl)-bipheny...) Show SMILES COc1ccc(cc1\C=C/C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C19H20O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h4-5,7-13,20H,1,6H2,2-3H3/b7-5-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM17638 (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 KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50295925 ((E)-3'-Propenyl)-5-(2-propenyl)-biphenyl-2,4'-diol...) Show SMILES C\C=C\c1cc(ccc1O)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,6-12,19-20H,1,5H2,2H3/b6-4+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM17638 (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 KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.09E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Graz Curated by ChEMBL					Assay Description Inhibition of ram seminal vesicle COX1 assessed as PGE2 level by EIA				Bioorg Med Chem 18: 2809-15 (2010) Article DOI: 10.1016/j.bmc.2009.10.031 BindingDB Entry DOI: 10.7270/Q2MG7PNG
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50295924 (4'-Methoxy-3'-(Z)-propenyl)-5-(2-propenyl)-bipheny...) Show SMILES COc1ccc(cc1\C=C/C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C19H20O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h4-5,7-13,20H,1,6H2,2-3H3/b7-5-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50295920 (4'-Methoxy-5,3'-dipropyl-biphenyl-2ol | CHEMBL5552...) Show SMILES CCCc1ccc(O)c(c1)-c1ccc(OC)c(CCC)c1 Show InChI InChI=1S/C19H24O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h8-13,20H,4-7H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50295926 (4'-O-methylhonokiol, MH | 4-methoxyhonokiol | ...) Show SMILES COc1ccc(cc1CC=C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C19H20O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h4-5,8-13,20H,1-2,6-7H2,3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50157312 (5,3''-Dipropyl-biphenyl-2,4''-diol | 5,3'-Dipropyl...) Show SMILES CCCc1ccc(O)c(c1)-c1ccc(O)c(CCC)c1 Show InChI InChI=1S/C18H22O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h7-12,19-20H,3-6H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM50157304 (3',5-di-2-propenyl-1,1'-biphenyl-2,4'-diol | 3',5-...) Show SMILES Oc1ccc(cc1CC=C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50295923 (4'-Methoxy-3'-(E)-propenyl)-5-(2-propenyl)-bipheny...) Show SMILES COc1ccc(cc1\C=C\C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C19H20O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h4-5,7-13,20H,1,6H2,2-3H3/b7-5+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50157304 (3',5-di-2-propenyl-1,1'-biphenyl-2,4'-diol | 3',5-...) Show SMILES Oc1ccc(cc1CC=C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50157312 (5,3''-Dipropyl-biphenyl-2,4''-diol | 5,3'-Dipropyl...) Show SMILES CCCc1ccc(O)c(c1)-c1ccc(O)c(CCC)c1 Show InChI InChI=1S/C18H22O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h7-12,19-20H,3-6H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50295921 (2-Acetoxy-4'-methoxy-5,3'-di-(2-propenyl)-biphenyl...) Show SMILES COc1ccc(cc1CC=C)-c1cc(CC=C)ccc1OC(C)=O Show InChI InChI=1S/C21H22O3/c1-5-7-16-9-11-21(24-15(3)22)19(13-16)17-10-12-20(23-4)18(14-17)8-6-2/h5-6,9-14H,1-2,7-8H2,3-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50029593 (CHEMBL7162 | N-(2-(cyclohexyloxy)-4-nitrophenyl)me...) Show SMILES CS(=O)(=O)Nc1ccc(cc1OC1CCCCC1)[N+]([O-])=O Show InChI InChI=1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Graz Curated by ChEMBL					Assay Description Inhibition of sheep placental cotyledens COX2 assessed as PGE2 level by EIA				Bioorg Med Chem 18: 2809-15 (2010) Article DOI: 10.1016/j.bmc.2009.10.031 BindingDB Entry DOI: 10.7270/Q2MG7PNG
					More data for this Ligand-Target Pair				3D Structure (crystal)
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50029593 (CHEMBL7162 | N-(2-(cyclohexyloxy)-4-nitrophenyl)me...) Show SMILES CS(=O)(=O)Nc1ccc(cc1OC1CCCCC1)[N+]([O-])=O Show InChI InChI=1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair				3D Structure (crystal)
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50295925 ((E)-3'-Propenyl)-5-(2-propenyl)-biphenyl-2,4'-diol...) Show SMILES C\C=C\c1cc(ccc1O)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,6-12,19-20H,1,5H2,2H3/b6-4+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM50295924 (4'-Methoxy-3'-(Z)-propenyl)-5-(2-propenyl)-bipheny...) Show SMILES COc1ccc(cc1\C=C/C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C19H20O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h4-5,7-13,20H,1,6H2,2-3H3/b7-5-	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50157304 (3',5-di-2-propenyl-1,1'-biphenyl-2,4'-diol | 3',5-...) Show SMILES Oc1ccc(cc1CC=C)-c1cc(CC=C)ccc1O Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50315285 (CHEMBL1089840 | aR-6,7-dihydro-6-(10-hydroxyethyl)...) Show SMILES COc1cc2CC(C)(Cc3cc(OC)c(O)c(O)c3-c2c(O)c1O)C(C)O Show InChI InChI=1S/C20H24O7/c1-9(21)20(2)7-10-5-12(26-3)16(22)18(24)14(10)15-11(8-20)6-13(27-4)17(23)19(15)25/h5-6,9,21-25H,7-8H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Graz Curated by ChEMBL					Assay Description Inhibition of 5-LOX-mediated LTB4 production in stimulated human neutrophile granulocytes after 10 mins by EIA				Bioorg Med Chem 18: 2809-15 (2010) Article DOI: 10.1016/j.bmc.2009.10.031 BindingDB Entry DOI: 10.7270/Q2MG7PNG
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50315286 (CHEMBL1088887 | aR-6-(10-iodoethyl)-1,2,3,9,10,11-...) Show SMILES COc1cc2CC(C)(Cc3cc(OC)c(OC)c(OC)c3-c2c(OC)c1OC)C(C)I Show InChI InChI=1S/C24H31IO6/c1-13(25)24(2)11-14-9-16(26-3)20(28-5)22(30-7)18(14)19-15(12-24)10-17(27-4)21(29-6)23(19)31-8/h9-10,13H,11-12H2,1-8H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Graz Curated by ChEMBL					Assay Description Inhibition of 5-LOX-mediated LTB4 production in stimulated human neutrophile granulocytes after 10 mins by EIA				Bioorg Med Chem 18: 2809-15 (2010) Article DOI: 10.1016/j.bmc.2009.10.031 BindingDB Entry DOI: 10.7270/Q2MG7PNG
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50295922 (2,4'-Diacetoxy-5,3'-di-(2-propenyl)-biphenyl | CHE...) Show SMILES CC(=O)Oc1ccc(cc1CC=C)-c1cc(CC=C)ccc1OC(C)=O Show InChI InChI=1S/C22H22O4/c1-5-7-17-9-11-22(26-16(4)24)20(13-17)18-10-12-21(25-15(3)23)19(14-18)8-6-2/h5-6,9-14H,1-2,7-8H2,3-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50295921 (2-Acetoxy-4'-methoxy-5,3'-di-(2-propenyl)-biphenyl...) Show SMILES COc1ccc(cc1CC=C)-c1cc(CC=C)ccc1OC(C)=O Show InChI InChI=1S/C21H22O3/c1-5-7-16-9-11-21(24-15(3)22)19(13-16)17-10-12-20(23-4)18(14-17)8-6-2/h5-6,9-14H,1-2,7-8H2,3-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50000541 ((+-)-1-(1-Benzo[b]thien-2-ylethyl)-1-hydroxyurea |...) Show SMILES CC(N(O)C(N)=O)c1cc2ccccc2s1 Show InChI InChI=1S/C11H12N2O2S/c1-7(13(15)11(12)14)10-6-8-4-2-3-5-9(8)16-10/h2-7,15H,1H3,(H2,12,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Graz Curated by ChEMBL					Assay Description Inhibition of 5-LOX-mediated LTB4 production in stimulated human neutrophile granulocytes after 10 mins by EIA				Bioorg Med Chem 18: 2809-15 (2010) Article DOI: 10.1016/j.bmc.2009.10.031 BindingDB Entry DOI: 10.7270/Q2MG7PNG
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50000541 ((+-)-1-(1-Benzo[b]thien-2-ylethyl)-1-hydroxyurea |...) Show SMILES CC(N(O)C(N)=O)c1cc2ccccc2s1 Show InChI InChI=1S/C11H12N2O2S/c1-7(13(15)11(12)14)10-6-8-4-2-3-5-9(8)16-10/h2-7,15H,1H3,(H2,12,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50295928 (2,4'-Dimethoxy-5,3'-dipropyl-biphenyl | CHEMBL5602...) Show SMILES CCCc1ccc(OC)c(c1)-c1ccc(OC)c(CCC)c1 Show InChI InChI=1S/C20H26O2/c1-5-7-15-9-11-20(22-4)18(13-15)16-10-12-19(21-3)17(14-16)8-6-2/h9-14H,5-8H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50295927 (2,4'-Dimethoxy-5,3'-di-(2-propenyl)-biphenyl | 5,3...) Show SMILES COc1ccc(cc1CC=C)-c1cc(CC=C)ccc1OC Show InChI InChI=1S/C20H22O2/c1-5-7-15-9-11-20(22-4)18(13-15)16-10-12-19(21-3)17(14-16)8-6-2/h5-6,9-14H,1-2,7-8H2,3-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX2 in sheep placental vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM50295920 (4'-Methoxy-5,3'-dipropyl-biphenyl-2ol | CHEMBL5552...) Show SMILES CCCc1ccc(O)c(c1)-c1ccc(OC)c(CCC)c1 Show InChI InChI=1S/C19H24O2/c1-4-6-14-8-10-18(20)17(12-14)15-9-11-19(21-3)16(13-15)7-5-2/h8-13,20H,4-7H2,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM50295927 (2,4'-Dimethoxy-5,3'-di-(2-propenyl)-biphenyl | 5,3...) Show SMILES COc1ccc(cc1CC=C)-c1cc(CC=C)ccc1OC Show InChI InChI=1S/C20H22O2/c1-5-7-15-9-11-20(22-4)18(13-15)16-10-12-19(21-3)17(14-16)8-6-2/h5-6,9-14H,1-2,7-8H2,3-4H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50295927 (2,4'-Dimethoxy-5,3'-di-(2-propenyl)-biphenyl | 5,3...) Show SMILES COc1ccc(cc1CC=C)-c1cc(CC=C)ccc1OC Show InChI InChI=1S/C20H22O2/c1-5-7-15-9-11-20(22-4)18(13-15)16-10-12-19(21-3)17(14-16)8-6-2/h5-6,9-14H,1-2,7-8H2,3-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of 5LOX-mediated LTB4 formation in stimulated human polymorphonuclear leukocytes				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Ovis aries (Sheep))	BDBM50295928 (2,4'-Dimethoxy-5,3'-dipropyl-biphenyl | CHEMBL5602...) Show SMILES CCCc1ccc(OC)c(c1)-c1ccc(OC)c(CCC)c1 Show InChI InChI=1S/C20H26O2/c1-5-7-15-9-11-20(22-4)18(13-15)16-10-12-19(21-3)17(14-16)8-6-2/h9-14H,5-8H2,1-4H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Karl-Franzens-Universit£t Graz Curated by ChEMBL					Assay Description Inhibition of COX1 in ram seminal vesicle by enzyme immunoassay				Bioorg Med Chem 17: 4459-65 (2009) Article DOI: 10.1016/j.bmc.2009.05.018 BindingDB Entry DOI: 10.7270/Q2SX6D9B
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Ovis aries (Sheep))	BDBM50315284 (CHEMBL1089510 | aR-6,7-Dihydro-6-(10-hydroxyethyl)...) Show SMILES CC(O)C1(C)Cc2cc(O)c(O)c(O)c2-c2c(C1)cc(O)c(O)c2O Show InChI InChI=1S/C18H20O7/c1-7(19)18(2)5-8-3-10(20)14(22)16(24)12(8)13-9(6-18)4-11(21)15(23)17(13)25/h3-4,7,19-25H,5-6H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.21E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Graz Curated by ChEMBL					Assay Description Inhibition of sheep placental cotyledens COX2 assessed as PGE2 level by EIA				Bioorg Med Chem 18: 2809-15 (2010) Article DOI: 10.1016/j.bmc.2009.10.031 BindingDB Entry DOI: 10.7270/Q2MG7PNG
					More data for this Ligand-Target Pair