Compile Data Set for Download or QSAR

Found 37 hits with Last Name = 'surette' and Initial = 'me'   

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
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583291 (CHEMBL5085074) Show SMILES COc1cc(\C=C\C(=O)OCCc2cccc(c2)C(F)(F)F)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583293 (CHEMBL5088008) Show SMILES COc1cc(\C=C\C(=O)OCCc2cccc(C)c2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583295 (CHEMBL5093372) Show SMILES COc1cccc(CCOC(=O)\C=C\c2cc(OC)c(O)c(OC)c2)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583289 (CHEMBL5080803) Show SMILES COc1cc(\C=C\C(=O)OCCc2cccc(F)c2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583294 (CHEMBL5072274) Show SMILES COc1cc(\C=C\C(=O)OCCc2ccccc2C)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583290 (CHEMBL5088166) Show SMILES COc1cc(\C=C\C(=O)OCCc2ccccc2F)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	240	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583296 (CHEMBL5085633) Show SMILES COc1cc(\C=C\C(=O)OCCc2ccccc2OC)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583308 (CHEMBL5089203) Show SMILES COc1cc(\C=C\c2nc(CCc3ccccc3)no2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583302 (CHEMBL5071392) Show SMILES COc1cc(\C=C\C(=O)OCCc2ccccc2)cc(OC)c1OC(C)=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583307 (CHEMBL5072348) Show SMILES COc1cc(\C=C\c2nc(Cc3ccccc3)no2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583288 (CHEMBL4794186) Show SMILES COc1cc(\C=C\C(=O)OCCc2ccccc2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50029225 ((E)-3-(2,5-Dihydroxy-phenyl)-acrylic acid phenethy...) Show SMILES Oc1ccc(O)c(\C=C\C(=O)OCCc2ccccc2)c1 Show InChI InChI=1S/C17H16O4/c18-15-7-8-16(19)14(12-15)6-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-6+	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	330	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50029225 ((E)-3-(2,5-Dihydroxy-phenyl)-acrylic acid phenethy...) Show SMILES Oc1ccc(O)c(\C=C\C(=O)OCCc2ccccc2)c1 Show InChI InChI=1S/C17H16O4/c18-15-7-8-16(19)14(12-15)6-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-6+	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	330	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583298 (CHEMBL4759754) Show SMILES COc1cc(\C=C\C(=O)OCCCc2ccccc2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583292 (CHEMBL5073724) Show SMILES COc1cc(\C=C\C(=O)OCCc2ccccc2C(F)(F)F)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583303 (CHEMBL5092055) Show SMILES COc1cc(\C=C\C(=O)CCc2ccccc2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583304 (CHEMBL5077729) Show SMILES COc1cc(CCC(=O)CCc2ccccc2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50530377 (CHEMBL4579523) Show SMILES Oc1ccc(O)c(\C=C\C(=O)CCc2ccccc2)c1 Show InChI InChI=1S/C17H16O3/c18-15(8-6-13-4-2-1-3-5-13)9-7-14-12-16(19)10-11-17(14)20/h1-5,7,9-12,19-20H,6,8H2/b9-7+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50530377 (CHEMBL4579523) Show SMILES Oc1ccc(O)c(\C=C\C(=O)CCc2ccccc2)c1 Show InChI InChI=1S/C17H16O3/c18-15(8-6-13-4-2-1-3-5-13)9-7-14-12-16(19)10-11-17(14)20/h1-5,7,9-12,19-20H,6,8H2/b9-7+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583306 (CHEMBL5084797) Show SMILES COc1cc(\C=C\COCCCc2ccccc2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583301 (CHEMBL5078319) Show SMILES COc1cc(CCC(=O)OCCc2ccccc2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50277011 ((2E,2'E)-(1,1'-(2,2-bis((4-(((E)-3-(3,4-dihydroxyp...) Show SMILES Oc1ccc(\C=C\C(=O)OCc2cn(CC(Cn3cc(COC(=O)\C=C\c4ccc(O)c(O)c4)nn3)(Cn3cc(COC(=O)\C=C\c4ccc(O)c(O)c4)nn3)Cn3cc(COC(=O)\C=C\c4ccc(O)c(O)c4)nn3)nn2)cc1O Show InChI InChI=1S/C53H48N12O16/c66-41-9-1-33(17-45(41)70)5-13-49(74)78-25-37-21-62(58-54-37)29-53(30-63-22-38(55-59-63)26-79-50(75)14-6-34-2-10-42(67)46(71)18-34,31-64-23-39(56-60-64)27-80-51(76)15-7-35-3-11-43(68)47(72)19-35)32-65-24-40(57-61-65)28-81-52(77)16-8-36-4-12-44(69)48(73)20-36/h1-24,66-73H,25-32H2/b13-5+,14-6+,15-7+,16-8+	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	660	n/a	n/a	n/a	n/a	n/a	n/a
Université de Moncton Curated by ChEMBL					Assay Description Inhibition of human 5LOX expressed in HEK293 cells				Bioorg Med Chem Lett 19: 1118-21 (2009) Article DOI: 10.1016/j.bmcl.2008.12.108 BindingDB Entry DOI: 10.7270/Q21R6QCD
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50276981 ((E)-2-(4-(cinnamoyloxymethyl)-1H-1,2,3-triazol-1-y...) Show SMILES Oc1ccc(\C=C\C(=O)OCCn2cc(COC(=O)\C=C\c3ccccc3)nn2)cc1O Show InChI InChI=1S/C23H21N3O6/c27-20-9-6-18(14-21(20)28)8-11-22(29)31-13-12-26-15-19(24-25-26)16-32-23(30)10-7-17-4-2-1-3-5-17/h1-11,14-15,27-28H,12-13,16H2/b10-7+,11-8+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
Université de Moncton Curated by ChEMBL					Assay Description Inhibition of human 5LOX expressed in HEK293 cells				Bioorg Med Chem Lett 19: 1118-21 (2009) Article DOI: 10.1016/j.bmcl.2008.12.108 BindingDB Entry DOI: 10.7270/Q21R6QCD
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583297 (CHEMBL5084822) Show SMILES CCCOC(=O)\C=C\c1cc(OC)c(O)c(OC)c1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	710	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50277009 ((E)-(1-(2-((E)-3-(3,4-dihydroxyphenyl)acryloyloxy)...) Show SMILES Oc1ccc(\C=C\C(=O)OCCn2cc(COC(=O)\C=C\c3ccc(O)c(O)c3)nn2)cc1O Show InChI InChI=1S/C23H21N3O8/c27-18-5-1-15(11-20(18)29)3-7-22(31)33-10-9-26-13-17(24-25-26)14-34-23(32)8-4-16-2-6-19(28)21(30)12-16/h1-8,11-13,27-30H,9-10,14H2/b7-3+,8-4+	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	740	n/a	n/a	n/a	n/a	n/a	n/a
Université de Moncton Curated by ChEMBL					Assay Description Inhibition of human 5LOX expressed in HEK293 cells				Bioorg Med Chem Lett 19: 1118-21 (2009) Article DOI: 10.1016/j.bmcl.2008.12.108 BindingDB Entry DOI: 10.7270/Q21R6QCD
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50277010 ((2E,2'E)-(1,1'-(2-((4-(((E)-3-(3,4-dihydroxyphenyl...) Show SMILES OCC(Cn1cc(COC(=O)\C=C\c2ccc(O)c(O)c2)nn1)(Cn1cc(COC(=O)\C=C\c2ccc(O)c(O)c2)nn1)Cn1cc(COC(=O)\C=C\c2ccc(O)c(O)c2)nn1 Show InChI InChI=1S/C41H39N9O13/c51-25-41(22-48-16-29(42-45-48)19-61-38(58)10-4-26-1-7-32(52)35(55)13-26,23-49-17-30(43-46-49)20-62-39(59)11-5-27-2-8-33(53)36(56)14-27)24-50-18-31(44-47-50)21-63-40(60)12-6-28-3-9-34(54)37(57)15-28/h1-18,51-57H,19-25H2/b10-4+,11-5+,12-6+	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	790	n/a	n/a	n/a	n/a	n/a	n/a
Université de Moncton Curated by ChEMBL					Assay Description Inhibition of human 5LOX expressed in HEK293 cells				Bioorg Med Chem Lett 19: 1118-21 (2009) Article DOI: 10.1016/j.bmcl.2008.12.108 BindingDB Entry DOI: 10.7270/Q21R6QCD
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50530376 (CHEMBL4582170) Show SMILES Oc1cccc(\C=C\C(=O)OCCc2ccccc2)c1O Show InChI InChI=1S/C17H16O4/c18-15-8-4-7-14(17(15)20)9-10-16(19)21-12-11-13-5-2-1-3-6-13/h1-10,18,20H,11-12H2/b10-9+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	890	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50530376 (CHEMBL4582170) Show SMILES Oc1cccc(\C=C\C(=O)OCCc2ccccc2)c1O Show InChI InChI=1S/C17H16O4/c18-15-8-4-7-14(17(15)20)9-10-16(19)21-12-11-13-5-2-1-3-6-13/h1-10,18,20H,11-12H2/b10-9+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	890	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583299 (CHEMBL5084841) Show SMILES COc1cc(\C=C\C(=O)NCCc2ccccc2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	960	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50029207 ((E)-3-(3,4-Dihydroxy-phenyl)-acrylic acid phenethy...) Show SMILES Oc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O Show InChI InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	970	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50029207 ((E)-3-(3,4-Dihydroxy-phenyl)-acrylic acid phenethy...) Show SMILES Oc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O Show InChI InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	970	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583305 (CHEMBL5079669) Show SMILES COc1cc(\C=C\COCc2ccccc2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM50583300 (CHEMBL5074759) Show SMILES COc1cc(CC(=O)OCCc2ccccc2)cc(OC)c1O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					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	2.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					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	2.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of 5-LO in thapsigargin stimulated human PMNL cells assessed as reduction in 5-LO product level preincubated for 5 mins followed by thapsi...				Citation and Details Article DOI: 10.1021/acs.jnatprod.1c00982 BindingDB Entry DOI: 10.7270/Q2W099TK
					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	2.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of 5-LO in human PMNL cells assessed as reduction in leukotriene formation preincubated for 5 mins followed by thapsigargin stimulation me...				Eur J Med Chem 179: 347-357 (2019) Article DOI: 10.1016/j.ejmech.2019.06.060 BindingDB Entry DOI: 10.7270/Q2125X31
					More data for this Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase (Homo sapiens (Human))	BDBM4375 ((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...) Show SMILES OC(=O)\C=C\c1ccc(O)c(O)c1 Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+	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	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Université de Moncton Curated by ChEMBL					Assay Description Inhibition of human 5LOX expressed in HEK293 cells				Bioorg Med Chem Lett 19: 1118-21 (2009) Article DOI: 10.1016/j.bmcl.2008.12.108 BindingDB Entry DOI: 10.7270/Q21R6QCD
					More data for this Ligand-Target Pair