Compile Data Set for Download or QSAR

Found 47 hits with Last Name = 'franke' and Initial = 'l'   

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 (Homo sapiens (Human))	BDBM13066 (2-{2-[(2,6-dichlorophenyl)amino]phenyl}acetic acid...) Show SMILES OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl Show InChI InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)	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 Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibitory concentration against COX-2 upon incubation for 15 minutes at 37 degree C				J Med Chem 48: 6997-7004 (2005) Article DOI: 10.1021/jm050619h BindingDB Entry DOI: 10.7270/Q2N29WH3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM11639 (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 Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibitory concentration against COX-2 upon incubation for 15 minutes at 37 degree C				J Med Chem 48: 6997-7004 (2005) Article DOI: 10.1021/jm050619h BindingDB Entry DOI: 10.7270/Q2N29WH3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM11639 (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 Article PubMed	n/a	n/a	6.80	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibitory concentration against COX-2; (valus obtained by Kato et al.)				J Med Chem 48: 6997-7004 (2005) Article DOI: 10.1021/jm050619h BindingDB Entry DOI: 10.7270/Q2N29WH3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM22369 (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	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibitory concentration against COX-2 upon incubation for 15 minutes at 37 degree C				J Med Chem 48: 6997-7004 (2005) Article DOI: 10.1021/jm050619h BindingDB Entry DOI: 10.7270/Q2N29WH3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM22369 (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	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibitory concentration against COX-2; (valus obtained by Kato et al.)				J Med Chem 48: 6997-7004 (2005) Article DOI: 10.1021/jm050619h BindingDB Entry DOI: 10.7270/Q2N29WH3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM13066 (2-{2-[(2,6-dichlorophenyl)amino]phenyl}acetic acid...) Show SMILES OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl Show InChI InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)	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 Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibitory concentration against COX-2; (valus obtained by Kato et al.)				J Med Chem 48: 6997-7004 (2005) Article DOI: 10.1021/jm050619h BindingDB Entry DOI: 10.7270/Q2N29WH3
					More data for this Ligand-Target Pair				3D Structure (crystal)
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50176068 (4-[1-(4-Chloro-phenyl)-1H-benzoimidazol-2-yl]-benz...) Show SMILES NS(=O)(=O)c1ccc(cc1)-c1nc2ccccc2n1-c1ccc(Cl)cc1 Show InChI InChI=1S/C19H14ClN3O2S/c20-14-7-9-15(10-8-14)23-18-4-2-1-3-17(18)22-19(23)13-5-11-16(12-6-13)26(21,24)25/h1-12H,(H2,21,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibitory concentration against COX-2 upon incubation for 15 minutes at 37 degree C				J Med Chem 48: 6997-7004 (2005) Article DOI: 10.1021/jm050619h BindingDB Entry DOI: 10.7270/Q2N29WH3
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211482 (1-(2,4-difluoro-phenyl)-3-(3,5a,10-trimethyl-2-oxo...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)Nc5ccc(F)cc5F)nc4C(C)C3C2OC1=O |w:5.5,27.29,1.0,2.2,28.32,25.27| Show InChI InChI=1S/C23H25F2N3O3S/c1-10-13-6-7-23(3)9-16-18(11(2)17(23)19(13)31-20(10)29)27-22(32-16)28-21(30)26-15-5-4-12(24)8-14(15)25/h4-5,8,10-11,13,17,19H,6-7,9H2,1-3H3,(H2,26,27,28,30)	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	600	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211478 (2-(7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphth...) Show SMILES COc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)Nc1ccccn1 |w:14.16,9.9| Show InChI InChI=1S/C21H26N2O2/c1-13-11-19(25-4)15(3)18-12-16(8-9-17(13)18)14(2)21(24)23-20-7-5-6-10-22-20/h5-7,10-11,14,16H,8-9,12H2,1-4H3,(H,22,23,24)	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	800	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211491 (2-(5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphth...) Show SMILES CCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)Nc1nccs1 |w:16.18,11.11| Show InChI InChI=1S/C21H28N2O2S/c1-5-9-25-19-11-13(2)17-7-6-16(12-18(17)15(19)4)14(3)20(24)23-21-22-8-10-26-21/h8,10-11,14,16H,5-7,9,12H2,1-4H3,(H,22,23,24)	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	800	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211496 (2-(5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphth...) Show SMILES CCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)Nc1ncc(C)s1 |w:16.18,11.11| Show InChI InChI=1S/C22H30N2O2S/c1-6-9-26-20-10-13(2)18-8-7-17(11-19(18)16(20)5)15(4)21(25)24-22-23-12-14(3)27-22/h10,12,15,17H,6-9,11H2,1-5H3,(H,23,24,25)	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	800	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211483 (3,4,5-trimethoxy-N-(3,5a,10-trimethyl-2-oxo-2,3,3a...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)Nc1nc2[C@@H](C)[C@@H]3[C@H]4OC(=O)[C@@H](C)[C@@H]4CC[C@@]3(C)Cc2s1 Show InChI InChI=1S/C26H32N2O6S/c1-12-15-7-8-26(3)11-18-20(13(2)19(26)21(15)34-24(12)30)27-25(35-18)28-23(29)14-9-16(31-4)22(33-6)17(10-14)32-5/h9-10,12-13,15,19,21H,7-8,11H2,1-6H3,(H,27,28,29)/t12-,13-,15-,19+,21-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase 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
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211495 (2-(5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphth...) Show SMILES CCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)Nc1ccccn1 |w:16.18,11.11| Show InChI InChI=1S/C23H30N2O2/c1-5-12-27-21-13-15(2)19-10-9-18(14-20(19)17(21)4)16(3)23(26)25-22-8-6-7-11-24-22/h6-8,11,13,16,18H,5,9-10,12,14H2,1-4H3,(H,24,25,26)	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	900	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211488 (CHEMBL376759 | N-(furan-2-ylmethyl)-2-(7-methoxy-5...) Show SMILES COc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NCc1ccco1 |w:14.16,9.9| Show InChI InChI=1S/C21H27NO3/c1-13-10-20(24-4)15(3)19-11-16(7-8-18(13)19)14(2)21(23)22-12-17-6-5-9-25-17/h5-6,9-10,14,16H,7-8,11-12H2,1-4H3,(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211489 (2-(7-(2-(dimethylamino)ethoxy)-5,8-dimethyl-1,2,3,...) Show SMILES CC(C1CCc2c(C)cc(OCCN(C)C)c(C)c2C1)C(=O)Nc1nccs1 |w:1.0,2.20| Show InChI InChI=1S/C22H31N3O2S/c1-14-12-20(27-10-9-25(4)5)16(3)19-13-17(6-7-18(14)19)15(2)21(26)24-22-23-8-11-28-22/h8,11-12,15,17H,6-7,9-10,13H2,1-5H3,(H,23,24,26)	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
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211496 (2-(5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphth...) Show SMILES CCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)Nc1ncc(C)s1 |w:16.18,11.11| Show InChI InChI=1S/C22H30N2O2S/c1-6-9-26-20-10-13(2)18-8-7-17(11-19(18)16(20)5)15(4)21(25)24-22-23-12-14(3)27-22/h10,12,15,17H,6-9,11H2,1-5H3,(H,23,24,25)	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
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211491 (2-(5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphth...) Show SMILES CCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)Nc1nccs1 |w:16.18,11.11| Show InChI InChI=1S/C21H28N2O2S/c1-5-9-25-19-11-13(2)17-7-6-16(12-18(17)15(19)4)14(3)20(24)23-21-22-8-10-26-21/h8,10-11,14,16H,5-7,9,12H2,1-4H3,(H,22,23,24)	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
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211484 (1-(3-methylsulfanyl-phenyl)-3-(3,5a,10-trimethyl-2...) Show SMILES CSc1cccc(NC(=O)Nc2nc3C(C)C4C5OC(=O)C(C)C5CCC4(C)Cc3s2)c1 |w:26.28,16.27,21.21,23.24,17.17,14.14| Show InChI InChI=1S/C24H29N3O3S2/c1-12-16-8-9-24(3)11-17-19(13(2)18(24)20(16)30-21(12)28)26-23(32-17)27-22(29)25-14-6-5-7-15(10-14)31-4/h5-7,10,12-13,16,18,20H,8-9,11H2,1-4H3,(H2,25,26,27,29)	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
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211481 (CHEMBL226814 | benzo[1,3]dioxole-5-carboxylic acid...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)c5ccc6OCOc6c5)nc4C(C)C3C2OC1=O |w:1.0,27.30,28.33,2.2,5.5,25.28| Show InChI InChI=1S/C24H26N2O5S/c1-11-14-6-7-24(3)9-17-19(12(2)18(24)20(14)31-22(11)28)25-23(32-17)26-21(27)13-4-5-15-16(8-13)30-10-29-15/h4-5,8,11-12,14,18,20H,6-7,9-10H2,1-3H3,(H,25,26,27)	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	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211490 (2-(5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphth...) Show SMILES CCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NCc1cccs1 |w:16.18,11.11| Show InChI InChI=1S/C23H31NO2S/c1-5-10-26-22-12-15(2)20-9-8-18(13-21(20)17(22)4)16(3)23(25)24-14-19-7-6-11-27-19/h6-7,11-12,16,18H,5,8-10,13-14H2,1-4H3,(H,24,25)	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	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211479 (1-benzyl-3-(3,5a,10-trimethyl-2-oxo-2,3,3a,4,5,5a,...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)NCc5ccccc5)nc4C(C)C3C2OC1=O |w:27.31,24.26,5.5,26.28,1.0,2.2| Show InChI InChI=1S/C24H29N3O3S/c1-13-16-9-10-24(3)11-17-19(14(2)18(24)20(16)30-21(13)28)26-23(31-17)27-22(29)25-12-15-7-5-4-6-8-15/h4-8,13-14,16,18,20H,9-12H2,1-3H3,(H2,25,26,27,29)	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	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM7460 (2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...) Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211487 (CHEMBL227301 | N-tert-butyl-2-(7-methoxy-5,8-dimet...) Show SMILES COc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NC(C)(C)C |w:14.16,9.9| Show InChI InChI=1S/C20H31NO2/c1-12-10-18(23-7)14(3)17-11-15(8-9-16(12)17)13(2)19(22)21-20(4,5)6/h10,13,15H,8-9,11H2,1-7H3,(H,21,22)	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	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211484 (1-(3-methylsulfanyl-phenyl)-3-(3,5a,10-trimethyl-2...) Show SMILES CSc1cccc(NC(=O)Nc2nc3C(C)C4C5OC(=O)C(C)C5CCC4(C)Cc3s2)c1 |w:26.28,16.27,21.21,23.24,17.17,14.14| Show InChI InChI=1S/C24H29N3O3S2/c1-12-16-8-9-24(3)11-17-19(13(2)18(24)20(16)30-21(12)28)26-23(32-17)27-22(29)25-14-6-5-7-15(10-14)31-4/h5-7,10,12-13,16,18,20H,8-9,11H2,1-4H3,(H2,25,26,27,29)	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	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211485 (2-(2-methoxy-phenyl)-N-(3,5a,10-trimethyl-2-oxo-2,...) Show SMILES COc1ccccc1CC(=O)Nc1nc2C(C)C3C4OC(=O)C(C)C4CCC3(C)Cc2s1 |w:18.19,15.16,27.30,17.29,22.23,24.26| Show InChI InChI=1S/C25H30N2O4S/c1-13-16-9-10-25(3)12-18-21(14(2)20(25)22(16)31-23(13)29)27-24(32-18)26-19(28)11-15-7-5-6-8-17(15)30-4/h5-8,13-14,16,20,22H,9-12H2,1-4H3,(H,26,27,28)	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	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211478 (2-(7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphth...) Show SMILES COc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)Nc1ccccn1 |w:14.16,9.9| Show InChI InChI=1S/C21H26N2O2/c1-13-11-19(25-4)15(3)18-12-16(8-9-17(13)18)14(2)21(24)23-20-7-5-6-10-22-20/h5-7,10-11,14,16H,8-9,12H2,1-4H3,(H,22,23,24)	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	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211480 (4-methoxy-N-(3,5a,10-trimethyl-2-oxo-2,3,3a,4,5,5a...) Show SMILES COc1ccc(cc1)C(=O)Nc1nc2C(C)C3C4OC(=O)C(C)C4CCC3(C)Cc2s1 |w:16.16,23.25,14.15,26.29,17.18,21.22| Show InChI InChI=1S/C24H28N2O4S/c1-12-16-9-10-24(3)11-17-19(13(2)18(24)20(16)30-22(12)28)25-23(31-17)26-21(27)14-5-7-15(29-4)8-6-14/h5-8,12-13,16,18,20H,9-11H2,1-4H3,(H,25,26,27)	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	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211495 (2-(5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphth...) Show SMILES CCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)Nc1ccccn1 |w:16.18,11.11| Show InChI InChI=1S/C23H30N2O2/c1-5-12-27-21-13-15(2)19-10-9-18(14-20(19)17(21)4)16(3)23(26)25-22-8-6-7-11-24-22/h6-8,11,13,16,18H,5,9-10,12,14H2,1-4H3,(H,24,25,26)	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	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211482 (1-(2,4-difluoro-phenyl)-3-(3,5a,10-trimethyl-2-oxo...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)Nc5ccc(F)cc5F)nc4C(C)C3C2OC1=O |w:5.5,27.29,1.0,2.2,28.32,25.27| Show InChI InChI=1S/C23H25F2N3O3S/c1-10-13-6-7-23(3)9-16-18(11(2)17(23)19(13)31-20(10)29)27-22(32-16)28-21(30)26-15-5-4-12(24)8-14(15)25/h4-5,8,10-11,13,17,19H,6-7,9H2,1-3H3,(H2,26,27,28,30)	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	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211494 (2-(7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphth...) Show SMILES COc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NCc1cccs1 |w:14.16,9.9| Show InChI InChI=1S/C21H27NO2S/c1-13-10-20(24-4)15(3)19-11-16(7-8-18(13)19)14(2)21(23)22-12-17-6-5-9-25-17/h5-6,9-10,14,16H,7-8,11-12H2,1-4H3,(H,22,23)	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	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211492 (CHEMBL227139 | cyclopentanecarboxylic acid (3,5a,1...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)C5CCCC5)nc4C(C)C3C2OC1=O |w:23.24,24.28,21.23,5.5,1.0,2.2| Show InChI InChI=1S/C22H30N2O3S/c1-11-14-8-9-22(3)10-15-17(12(2)16(22)18(14)27-20(11)26)23-21(28-15)24-19(25)13-6-4-5-7-13/h11-14,16,18H,4-10H2,1-3H3,(H,23,24,25)	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	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50176069 (4-[1-(2-Methoxy-phenyl)-1H-benzoimidazol-2-yl]-ben...) Show SMILES COc1ccccc1-n1c(nc2ccccc12)-c1ccc(cc1)S(N)(=O)=O |(2.46,2.44,;3.51,1.31,;5,1.63,;5.47,3.1,;6.98,3.42,;8.03,2.28,;7.54,.82,;6.04,.51,;5.56,-.96,;6.47,-2.22,;5.56,-3.45,;4.09,-2.97,;2.78,-3.74,;1.43,-2.97,;1.43,-1.43,;2.78,-.66,;4.09,-1.43,;8.01,-2.22,;8.77,-3.55,;10.31,-3.55,;11.09,-2.22,;10.31,-.89,;8.78,-.89,;12.63,-2.22,;14.17,-2.22,;12.62,-3.76,;12.62,-.68,)| Show InChI InChI=1S/C20H17N3O3S/c1-26-19-9-5-4-8-18(19)23-17-7-3-2-6-16(17)22-20(23)14-10-12-15(13-11-14)27(21,24)25/h2-13H,1H3,(H2,21,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibitory concentration against COX-2 upon incubation for 15 minutes at 37 degree C				J Med Chem 48: 6997-7004 (2005) Article DOI: 10.1021/jm050619h BindingDB Entry DOI: 10.7270/Q2N29WH3
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211490 (2-(5,8-dimethyl-7-propoxy-1,2,3,4-tetrahydronaphth...) Show SMILES CCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NCc1cccs1 |w:16.18,11.11| Show InChI InChI=1S/C23H31NO2S/c1-5-10-26-22-12-15(2)20-9-8-18(13-21(20)17(22)4)16(3)23(25)24-14-19-7-6-11-27-19/h6-7,11-12,16,18H,5,8-10,13-14H2,1-4H3,(H,24,25)	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	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211483 (3,4,5-trimethoxy-N-(3,5a,10-trimethyl-2-oxo-2,3,3a...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)Nc1nc2[C@@H](C)[C@@H]3[C@H]4OC(=O)[C@@H](C)[C@@H]4CC[C@@]3(C)Cc2s1 Show InChI InChI=1S/C26H32N2O6S/c1-12-15-7-8-26(3)11-18-20(13(2)19(26)21(15)34-24(12)30)27-25(35-18)28-23(29)14-9-16(31-4)22(33-6)17(10-14)32-5/h9-10,12-13,15,19,21H,7-8,11H2,1-6H3,(H,27,28,29)/t12-,13-,15-,19+,21-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211494 (2-(7-methoxy-5,8-dimethyl-1,2,3,4-tetrahydronaphth...) Show SMILES COc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NCc1cccs1 |w:14.16,9.9| Show InChI InChI=1S/C21H27NO2S/c1-13-10-20(24-4)15(3)19-11-16(7-8-18(13)19)14(2)21(23)22-12-17-6-5-9-25-17/h5-6,9-10,14,16H,7-8,11-12H2,1-4H3,(H,22,23)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211479 (1-benzyl-3-(3,5a,10-trimethyl-2-oxo-2,3,3a,4,5,5a,...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)NCc5ccccc5)nc4C(C)C3C2OC1=O |w:27.31,24.26,5.5,26.28,1.0,2.2| Show InChI InChI=1S/C24H29N3O3S/c1-13-16-9-10-24(3)11-17-19(14(2)18(24)20(16)30-21(13)28)26-23(31-17)27-22(29)25-12-15-7-5-4-6-8-15/h4-8,13-14,16,18,20H,9-12H2,1-3H3,(H2,25,26,27,29)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211493 (CHEMBL373949 | N-cyclopentyl-2-[7-(2-methoxy-ethox...) Show SMILES COCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NC1CCCC1 |w:17.19,12.12| Show InChI InChI=1S/C23H35NO3/c1-15-13-22(27-12-11-26-4)17(3)21-14-18(9-10-20(15)21)16(2)23(25)24-19-7-5-6-8-19/h13,16,18-19H,5-12,14H2,1-4H3,(H,24,25)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211488 (CHEMBL376759 | N-(furan-2-ylmethyl)-2-(7-methoxy-5...) Show SMILES COc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NCc1ccco1 |w:14.16,9.9| Show InChI InChI=1S/C21H27NO3/c1-13-10-20(24-4)15(3)19-11-16(7-8-18(13)19)14(2)21(23)22-12-17-6-5-9-25-17/h5-6,9-10,14,16H,7-8,11-12H2,1-4H3,(H,22,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211492 (CHEMBL227139 | cyclopentanecarboxylic acid (3,5a,1...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)C5CCCC5)nc4C(C)C3C2OC1=O |w:23.24,24.28,21.23,5.5,1.0,2.2| Show InChI InChI=1S/C22H30N2O3S/c1-11-14-8-9-22(3)10-15-17(12(2)16(22)18(14)27-20(11)26)23-21(28-15)24-19(25)13-6-4-5-7-13/h11-14,16,18H,4-10H2,1-3H3,(H,23,24,25)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211493 (CHEMBL373949 | N-cyclopentyl-2-[7-(2-methoxy-ethox...) Show SMILES COCCOc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NC1CCCC1 |w:17.19,12.12| Show InChI InChI=1S/C23H35NO3/c1-15-13-22(27-12-11-26-4)17(3)21-14-18(9-10-20(15)21)16(2)23(25)24-19-7-5-6-8-19/h13,16,18-19H,5-12,14H2,1-4H3,(H,24,25)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211480 (4-methoxy-N-(3,5a,10-trimethyl-2-oxo-2,3,3a,4,5,5a...) Show SMILES COc1ccc(cc1)C(=O)Nc1nc2C(C)C3C4OC(=O)C(C)C4CCC3(C)Cc2s1 |w:16.16,23.25,14.15,26.29,17.18,21.22| Show InChI InChI=1S/C24H28N2O4S/c1-12-16-9-10-24(3)11-17-19(13(2)18(24)20(16)30-22(12)28)25-23(31-17)26-21(27)14-5-7-15(29-4)8-6-14/h5-8,12-13,16,18,20H,9-11H2,1-4H3,(H,25,26,27)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211486 (4-methyl-[1,2,3]thiadiazole-5-carboxylic acid (3,5...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)c5snnc5C)nc4C(C)C3C2OC1=O |w:25.29,22.24,5.5,24.26,1.0,2.2| Show InChI InChI=1S/C20H24N4O3S2/c1-8-11-5-6-20(4)7-12-14(9(2)13(20)15(11)27-18(8)26)21-19(28-12)22-17(25)16-10(3)23-24-29-16/h8-9,11,13,15H,5-7H2,1-4H3,(H,21,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211489 (2-(7-(2-(dimethylamino)ethoxy)-5,8-dimethyl-1,2,3,...) Show SMILES CC(C1CCc2c(C)cc(OCCN(C)C)c(C)c2C1)C(=O)Nc1nccs1 |w:1.0,2.20| Show InChI InChI=1S/C22H31N3O2S/c1-14-12-20(27-10-9-25(4)5)16(3)19-13-17(6-7-18(14)19)15(2)21(26)24-22-23-8-11-28-22/h8,11-12,15,17H,6-7,9-10,13H2,1-5H3,(H,23,24,26)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211481 (CHEMBL226814 | benzo[1,3]dioxole-5-carboxylic acid...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)c5ccc6OCOc6c5)nc4C(C)C3C2OC1=O |w:1.0,27.30,28.33,2.2,5.5,25.28| Show InChI InChI=1S/C24H26N2O5S/c1-11-14-6-7-24(3)9-17-19(12(2)18(24)20(14)31-22(11)28)25-23(32-17)26-21(27)13-4-5-15-16(8-13)30-10-29-15/h4-5,8,11-12,14,18,20H,6-7,9-10H2,1-3H3,(H,25,26,27)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211487 (CHEMBL227301 | N-tert-butyl-2-(7-methoxy-5,8-dimet...) Show SMILES COc1cc(C)c2CCC(Cc2c1C)C(C)C(=O)NC(C)(C)C |w:14.16,9.9| Show InChI InChI=1S/C20H31NO2/c1-12-10-18(23-7)14(3)17-11-15(8-9-16(12)17)13(2)19(22)21-20(4,5)6/h10,13,15H,8-9,11H2,1-7H3,(H,21,22)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of 5-LO activity in ionophore A23187 and arachidonic-stimulated human intact PMNL				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211485 (2-(2-methoxy-phenyl)-N-(3,5a,10-trimethyl-2-oxo-2,...) Show SMILES COc1ccccc1CC(=O)Nc1nc2C(C)C3C4OC(=O)C(C)C4CCC3(C)Cc2s1 |w:18.19,15.16,27.30,17.29,22.23,24.26| Show InChI InChI=1S/C25H30N2O4S/c1-13-16-9-10-25(3)12-18-21(14(2)20(25)22(16)31-23(13)29)27-24(32-18)26-19(28)11-15-7-5-6-8-17(15)30-4/h5-8,13-14,16,20,22H,9-12H2,1-4H3,(H,26,27,28)	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50211486 (4-methyl-[1,2,3]thiadiazole-5-carboxylic acid (3,5...) Show SMILES CC1C2CCC3(C)Cc4sc(NC(=O)c5snnc5C)nc4C(C)C3C2OC1=O |w:25.29,22.24,5.5,24.26,1.0,2.2| Show InChI InChI=1S/C20H24N4O3S2/c1-8-11-5-6-20(4)7-12-14(9(2)13(20)15(11)27-18(8)26)21-19(28-12)22-17(25)16-10(3)23-24-29-16/h8-9,11,13,15H,5-7H2,1-4H3,(H,21,22,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Johann Wolfgang Goethe-Universität Curated by ChEMBL					Assay Description Inhibition of partially purified human 5-LO expressed in Escherichia coli				J Med Chem 50: 2640-6 (2007) Article DOI: 10.1021/jm060655w BindingDB Entry DOI: 10.7270/Q21N80T8
					More data for this Ligand-Target Pair