Compile Data Set for Download or QSAR

Found 105 hits with Last Name = 'doiron' and Initial = 'j'   

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
Aromatase (Homo sapiens (Human))	BDBM50047260 (4,4'-((1H-imidazol-1-yl)methylene)dibenzonitrile |...) Show SMILES N#Cc1ccc(cc1)C(c1ccc(cc1)C#N)n1ccnc1 Show InChI InChI=1S/C18H12N4/c19-11-14-1-5-16(6-2-14)18(22-10-9-21-13-22)17-7-3-15(12-20)4-8-17/h1-10,13,18H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM50008733 (1-(4-Cyanobenzyl)-1H-imidazole | 4-((1H-imidazol-1...) Show SMILES N#Cc1ccc(Cn2ccnc2)cc1 Show InChI InChI=1S/C11H9N3/c12-7-10-1-3-11(4-2-10)8-14-6-5-13-9-14/h1-6,9H,8H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM13061 (4,4 -(1H-1,2,4-triazol-1-ylmethanediyl)dibenzonitr...) Show SMILES N#Cc1ccc(cc1)C(c1ccc(cc1)C#N)n1cncn1 Show InChI InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM50351827 (CHEMBL224789) Show SMILES N#Cc1ccc(cc1)C(c1ccc(cc1)C#N)n1ccnn1 Show InChI InChI=1S/C17H11N5/c18-11-13-1-5-15(6-2-13)17(22-10-9-20-21-22)16-7-3-14(12-19)4-8-16/h1-10,17H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM50014788 (1-Benzhydryl-1H-imidazole | CHEMBL336638) Show SMILES c1cn(cn1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C16H14N2/c1-3-7-14(8-4-1)16(18-12-11-17-13-18)15-9-5-2-6-10-15/h1-13,16H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM50351855 (CHEMBL1824769) Show SMILES N#Cc1ccc(Cn2ccnn2)cc1 Show InChI InChI=1S/C10H8N4/c11-7-9-1-3-10(4-2-9)8-14-6-5-12-13-14/h1-6H,8H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL 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
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM50351859 (CHEMBL1825020) Show SMILES N#Cc1ccc(Cn2cncn2)cc1 Show InChI InChI=1S/C10H8N4/c11-5-9-1-3-10(4-2-9)6-14-8-12-7-13-14/h1-4,7-8H,6H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM7887 (1-Benzylimidazole (BI) | 1-benzyl-1H-imidazole | 1...) Show SMILES C(c1ccccc1)n1ccnc1 Show InChI InChI=1S/C10H10N2/c1-2-4-10(5-3-1)8-12-7-6-11-9-12/h1-7,9H,8H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					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))	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))	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))	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))	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))	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))	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))	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))	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))	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))	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
Aromatase (Homo sapiens (Human))	BDBM50351863 (CHEMBL1825024) Show SMILES c1ncn(n1)C(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C15H13N3/c1-3-7-13(8-4-1)15(18-12-16-11-17-18)14-9-5-2-6-10-14/h1-12,15H	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					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))	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
Aromatase (Homo sapiens (Human))	BDBM50351885 (CHEMBL1825045) Show SMILES N#Cc1ccc(OCc2cn(Cc3ccccc3)nn2)cc1 Show InChI InChI=1S/C17H14N4O/c18-10-14-6-8-17(9-7-14)22-13-16-12-21(20-19-16)11-15-4-2-1-3-5-15/h1-9,12H,11,13H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM50351887 (CHEMBL1825047) Show SMILES Cc1ccc(OCc2cn(Cc3ccccc3)nn2)cc1 Show InChI InChI=1S/C17H17N3O/c1-14-7-9-17(10-8-14)21-13-16-12-20(19-18-16)11-15-5-3-2-4-6-15/h2-10,12H,11,13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					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
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
Aromatase (Homo sapiens (Human))	BDBM50351875 (CHEMBL1825036) Show SMILES COc1ccc(OCc2cn(Cc3ccc(cc3)C#N)nn2)cc1 Show InChI InChI=1S/C18H16N4O2/c1-23-17-6-8-18(9-7-17)24-13-16-12-22(21-20-16)11-15-4-2-14(10-19)3-5-15/h2-9,12H,11,13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM50351886 (CHEMBL1825046) Show SMILES [O-][N+](=O)c1ccc(OCc2cn(Cc3ccccc3)nn2)cc1 Show InChI InChI=1S/C16H14N4O3/c21-20(22)15-6-8-16(9-7-15)23-12-14-11-19(18-17-14)10-13-4-2-1-3-5-13/h1-9,11H,10,12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.78E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM50351866 (CHEMBL1825027) Show SMILES CCCCCCCc1cn(Cc2ccc(cc2)C#N)nn1 Show InChI InChI=1S/C17H22N4/c1-2-3-4-5-6-7-17-14-21(20-19-17)13-16-10-8-15(12-18)9-11-16/h8-11,14H,2-7,13H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Moncton Curated by ChEMBL					Assay Description Inhibition of aromatase using 7-methoxy-4-trifluoromethyl coumarin as substrate after 30 mins by fluorescence-based colorimetric analysis				Eur J Med Chem 46: 4010-24 (2011) Article DOI: 10.1016/j.ejmech.2011.05.074 BindingDB Entry DOI: 10.7270/Q2C24WTR
					More data for this Ligand-Target Pair

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