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PubMed code 8289184

Compile data set for download or QSAR
Found 45 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043670
PNG
(2-{(S)-1-[3-Fluoro-5-(naphthalen-2-ylmethoxy)-phen...)
Show SMILES CC[C@@](OC)(c1nccs1)c1cc(F)cc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H22FNO2S/c1-3-24(27-2,23-26-10-11-29-23)20-13-21(25)15-22(14-20)28-16-17-8-9-18-6-4-5-7-19(18)12-17/h4-15H,3,16H2,1-2H3/t24-/m0/s1
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n/an/a 0.700n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043682
PNG
((R)-2-[3-Fluoro-5-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES CC[C@](OC)(C(=O)OC)c1cc(F)cc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H23FO4/c1-4-23(27-3,22(25)26-2)19-12-20(24)14-21(13-19)28-15-16-9-10-17-7-5-6-8-18(17)11-16/h5-14H,4,15H2,1-3H3/t23-/m1/s1
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n/an/a 1.30n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043669
PNG
(6-[3-Fluoro-5-((S)-1-methoxy-1-thiazol-2-yl-propyl...)
Show SMILES CC[C@@](OC)(c1nccs1)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C24H23FN2O3S/c1-4-24(29-3,23-26-9-10-31-23)18-12-19(25)14-20(13-18)30-15-16-5-7-21-17(11-16)6-8-22(28)27(21)2/h5-14H,4,15H2,1-3H3/t24-/m0/s1
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n/an/a 1.60n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043677
PNG
((S)-2-[3-Fluoro-5-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES CC[C@@](OC)(C(=O)OC)c1cc(F)cc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H23FO4/c1-4-23(27-3,22(25)26-2)19-12-20(24)14-21(13-19)28-15-16-9-10-17-7-5-6-8-18(17)11-16/h5-14H,4,15H2,1-3H3/t23-/m0/s1
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n/an/a 5n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043666
PNG
((R)-2-[3-Fluoro-5-(1-methyl-2-oxo-1,2-dihydro-quin...)
Show SMILES CC[C@](OC)(C(=O)OC)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C23H24FNO5/c1-5-23(29-4,22(27)28-3)17-11-18(24)13-19(12-17)30-14-15-6-8-20-16(10-15)7-9-21(26)25(20)2/h6-13H,5,14H2,1-4H3/t23-/m1/s1
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n/an/a 9.60n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043678
PNG
((S)-2-[3-Fluoro-5-(1-methyl-2-oxo-1,2-dihydro-quin...)
Show SMILES CC[C@@](OC)(C(=O)OC)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C23H24FNO5/c1-5-23(29-4,22(27)28-3)17-11-18(24)13-19(12-17)30-14-15-6-8-20-16(10-15)7-9-21(26)25(20)2/h6-13H,5,14H2,1-4H3/t23-/m0/s1
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n/an/a 12n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50000829
PNG
(6-((3-fluoro-5-(4-methoxytetrahydro-2H-pyran-4-yl)...)
Show SMILES COC1(CCOCC1)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C23H24FNO4/c1-25-21-5-3-16(11-17(21)4-6-22(25)26)15-29-20-13-18(12-19(24)14-20)23(27-2)7-9-28-10-8-23/h3-6,11-14H,7-10,15H2,1-2H3
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n/an/a 27n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043676
PNG
(6-[3-Fluoro-5-((S)-1-methoxy-1-methoxymethyl-propy...)
Show SMILES CC[C@](COC)(OC)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C23H26FNO4/c1-5-23(28-4,15-27-3)18-11-19(24)13-20(12-18)29-14-16-6-8-21-17(10-16)7-9-22(26)25(21)2/h6-13H,5,14-15H2,1-4H3/t23-/m1/s1
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n/an/a 45n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043671
PNG
(6-[3-Fluoro-5-((R)-1-methoxy-1-methoxymethyl-propy...)
Show SMILES CC[C@@](COC)(OC)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C23H26FNO4/c1-5-23(28-4,15-27-3)18-11-19(24)13-20(12-18)29-14-16-6-8-21-17(10-16)7-9-22(26)25(21)2/h6-13H,5,14-15H2,1-4H3/t23-/m0/s1
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n/an/a 48n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50407160
PNG
(CHEMBL2092747)
Show SMILES CC[C@]1(CCO[C@H](C)C1)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1 |r|
Show InChI InChI=1S/C25H28FNO3/c1-4-25(9-10-29-17(2)15-25)20-12-21(26)14-22(13-20)30-16-18-5-7-23-19(11-18)6-8-24(28)27(23)3/h5-8,11-14,17H,4,9-10,15-16H2,1-3H3/t17-,25-/m1/s1
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n/an/a 60n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043676
PNG
(6-[3-Fluoro-5-((S)-1-methoxy-1-methoxymethyl-propy...)
Show SMILES CC[C@](COC)(OC)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C23H26FNO4/c1-5-23(28-4,15-27-3)18-11-19(24)13-20(12-18)29-14-16-6-8-21-17(10-16)7-9-22(26)25(21)2/h6-13H,5,14-15H2,1-4H3/t23-/m1/s1
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n/an/a 70n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043681
PNG
(4-[3-(1-Methyl-2-oxo-1,2-dihydro-quinolin-6-ylmeth...)
Show SMILES CCOC(=O)C1(CCOCC1)c1cccc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C25H27NO5/c1-3-30-24(28)25(11-13-29-14-12-25)20-5-4-6-21(16-20)31-17-18-7-9-22-19(15-18)8-10-23(27)26(22)2/h4-10,15-16H,3,11-14,17H2,1-2H3
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n/an/a 70n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043665
PNG
(6-[3-(4-Acetyl-tetrahydro-pyran-4-yl)-phenoxymethy...)
Show SMILES CC(=O)C1(CCOCC1)c1cccc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C24H25NO4/c1-17(26)24(10-12-28-13-11-24)20-4-3-5-21(15-20)29-16-18-6-8-22-19(14-18)7-9-23(27)25(22)2/h3-9,14-15H,10-13,16H2,1-2H3
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n/an/a 100n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043666
PNG
((R)-2-[3-Fluoro-5-(1-methyl-2-oxo-1,2-dihydro-quin...)
Show SMILES CC[C@](OC)(C(=O)OC)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C23H24FNO5/c1-5-23(29-4,22(27)28-3)17-11-18(24)13-19(12-17)30-14-15-6-8-20-16(10-15)7-9-21(26)25(20)2/h6-13H,5,14H2,1-4H3/t23-/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043668
PNG
(6-[3-(4-Ethyl-tetrahydro-pyran-4-yl)-phenoxymethyl...)
Show SMILES CCC1(CCOCC1)c1cccc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C24H27NO3/c1-3-24(11-13-27-14-12-24)20-5-4-6-21(16-20)28-17-18-7-9-22-19(15-18)8-10-23(26)25(22)2/h4-10,15-16H,3,11-14,17H2,1-2H3
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n/an/a 150n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043683
PNG
(6-[3-(4-Methoxymethyl-tetrahydro-pyran-4-yl)-pheno...)
Show SMILES COCC1(CCOCC1)c1cccc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C24H27NO4/c1-25-22-8-6-18(14-19(22)7-9-23(25)26)16-29-21-5-3-4-20(15-21)24(17-27-2)10-12-28-13-11-24/h3-9,14-15H,10-13,16-17H2,1-2H3
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n/an/a 170n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043672
PNG
(6-[3-Fluoro-5-((R)-1-methoxy-1-thiazol-2-yl-propyl...)
Show SMILES CC[C@](OC)(c1nccs1)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C24H23FN2O3S/c1-4-24(29-3,23-26-9-10-31-23)18-12-19(25)14-20(13-18)30-15-16-5-7-21-17(11-16)6-8-22(28)27(21)2/h5-14H,4,15H2,1-3H3/t24-/m1/s1
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Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043682
PNG
((R)-2-[3-Fluoro-5-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES CC[C@](OC)(C(=O)OC)c1cc(F)cc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H23FO4/c1-4-23(27-3,22(25)26-2)19-12-20(24)14-21(13-19)28-15-16-9-10-17-7-5-6-8-18(17)11-16/h5-14H,4,15H2,1-3H3/t23-/m1/s1
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Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043677
PNG
((S)-2-[3-Fluoro-5-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES CC[C@@](OC)(C(=O)OC)c1cc(F)cc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H23FO4/c1-4-23(27-3,22(25)26-2)19-12-20(24)14-21(13-19)28-15-16-9-10-17-7-5-6-8-18(17)11-16/h5-14H,4,15H2,1-3H3/t23-/m0/s1
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n/an/a 330n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043678
PNG
((S)-2-[3-Fluoro-5-(1-methyl-2-oxo-1,2-dihydro-quin...)
Show SMILES CC[C@@](OC)(C(=O)OC)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C23H24FNO5/c1-5-23(29-4,22(27)28-3)17-11-18(24)13-19(12-17)30-14-15-6-8-20-16(10-15)7-9-21(26)25(20)2/h6-13H,5,14H2,1-4H3/t23-/m0/s1
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Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50000857
PNG
(2-(1-methoxy-1-(3-(naphthalen-2-ylmethoxy)phenyl)p...)
Show SMILES CCC(OC)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H23NO2S/c1-3-24(26-2,23-25-13-14-28-23)21-9-6-10-22(16-21)27-17-18-11-12-19-7-4-5-8-20(19)15-18/h4-16H,3,17H2,1-2H3
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n/an/a 400n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043669
PNG
(6-[3-Fluoro-5-((S)-1-methoxy-1-thiazol-2-yl-propyl...)
Show SMILES CC[C@@](OC)(c1nccs1)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C24H23FN2O3S/c1-4-24(29-3,23-26-9-10-31-23)18-12-19(25)14-20(13-18)30-15-16-5-7-21-17(11-16)6-8-22(28)27(21)2/h5-14H,4,15H2,1-3H3/t24-/m0/s1
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n/an/a 410n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043664
PNG
(1-Methyl-6-[3-(4-methyl-tetrahydro-pyran-4-yl)-phe...)
Show SMILES Cn1c2ccc(COc3cccc(c3)C3(C)CCOCC3)cc2ccc1=O
Show InChI InChI=1S/C23H25NO3/c1-23(10-12-26-13-11-23)19-4-3-5-20(15-19)27-16-17-6-8-21-18(14-17)7-9-22(25)24(21)2/h3-9,14-15H,10-13,16H2,1-2H3
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n/an/a 440n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043675
PNG
(5-[1-Methoxy-6-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2ccc(OCc3ccc4ccccc4c3)cc12)c1cncs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-14-25-16-28-23)11-10-19-8-9-21(13-22(19)24)27-15-17-6-7-18-4-2-3-5-20(18)12-17/h2-9,12-14,16H,10-11,15H2,1H3
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n/an/a 500n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043667
PNG
(2-{(R)-1-Methoxy-1-[2-methyl-3-(naphthalen-2-ylmet...)
Show SMILES CO[C@@](C)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1C
Show InChI InChI=1S/C24H23NO2S/c1-17-21(24(2,26-3)23-25-13-14-28-23)9-6-10-22(17)27-16-18-11-12-19-7-4-5-8-20(19)15-18/h4-15H,16H2,1-3H3/t24-/m1/s1
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n/an/a 510n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043673
PNG
(2-{(R)-1-[3-Fluoro-5-(naphthalen-2-ylmethoxy)-phen...)
Show SMILES CC[C@](OC)(c1nccs1)c1cc(F)cc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H22FNO2S/c1-3-24(27-2,23-26-10-11-29-23)20-13-21(25)15-22(14-20)28-16-17-8-9-18-6-4-5-7-19(18)12-17/h4-15H,3,16H2,1-2H3/t24-/m1/s1
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n/an/a 513n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043671
PNG
(6-[3-Fluoro-5-((R)-1-methoxy-1-methoxymethyl-propy...)
Show SMILES CC[C@@](COC)(OC)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C23H26FNO4/c1-5-23(28-4,15-27-3)18-11-19(24)13-20(12-18)29-14-16-6-8-21-17(10-16)7-9-22(26)25(21)2/h6-13H,5,14-15H2,1-4H3/t23-/m0/s1
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n/an/a 520n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50007055
PNG
(4-{1-Methoxy-1-[3-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES CCC(OC)(c1cscn1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H23NO2S/c1-3-24(26-2,23-16-28-17-25-23)21-9-6-10-22(14-21)27-15-18-11-12-19-7-4-5-8-20(19)13-18/h4-14,16-17H,3,15H2,1-2H3
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n/an/a 600n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50007040
PNG
(2-[1-Methoxy-6-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2ccc(OCc3ccc4ccccc4c3)cc12)c1nccs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-25-12-13-28-23)11-10-19-8-9-21(15-22(19)24)27-16-17-6-7-18-4-2-3-5-20(18)14-17/h2-9,12-15H,10-11,16H2,1H3
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n/an/a 700n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043670
PNG
(2-{(S)-1-[3-Fluoro-5-(naphthalen-2-ylmethoxy)-phen...)
Show SMILES CC[C@@](OC)(c1nccs1)c1cc(F)cc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H22FNO2S/c1-3-24(27-2,23-26-10-11-29-23)20-13-21(25)15-22(14-20)28-16-17-8-9-18-6-4-5-7-19(18)12-17/h4-15H,3,16H2,1-2H3/t24-/m0/s1
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n/an/a 740n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043679
PNG
(6-[3-Fluoro-5-(4-hydroxy-tetrahydro-pyran-4-yl)-ph...)
Show SMILES Cn1c2ccc(COc3cc(F)cc(c3)C3(O)CCOCC3)cc2ccc1=O
Show InChI InChI=1S/C22H22FNO4/c1-24-20-4-2-15(10-16(20)3-5-21(24)25)14-28-19-12-17(11-18(23)13-19)22(26)6-8-27-9-7-22/h2-5,10-13,26H,6-9,14H2,1H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50007040
PNG
(2-[1-Methoxy-6-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2ccc(OCc3ccc4ccccc4c3)cc12)c1nccs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-25-12-13-28-23)11-10-19-8-9-21(15-22(19)24)27-16-17-6-7-18-4-2-3-5-20(18)14-17/h2-9,12-15H,10-11,16H2,1H3
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n/an/a 1.25E+3n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound against 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Mus musculus)
BDBM50043675
PNG
(5-[1-Methoxy-6-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2ccc(OCc3ccc4ccccc4c3)cc12)c1cncs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-14-25-16-28-23)11-10-19-8-9-21(13-22(19)24)27-15-17-6-7-18-4-2-3-5-20(18)12-17/h2-9,12-14,16H,10-11,15H2,1H3
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n/an/a 1.25E+3n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from mouse macrophage


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50407159
PNG
(CHEMBL2092993)
Show SMILES CC[C@]1(CCO[C@@H](C)C1)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1 |r|
Show InChI InChI=1S/C25H28FNO3/c1-4-25(9-10-29-17(2)15-25)20-12-21(26)14-22(13-20)30-16-18-5-7-23-19(11-18)6-8-24(28)27(23)3/h5-8,11-14,17H,4,9-10,15-16H2,1-3H3/t17-,25+/m0/s1
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n/an/a 1.90E+3n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043684
PNG
(6-[3-(4-Hydroxymethyl-tetrahydro-pyran-4-yl)-pheno...)
Show SMILES Cn1c2ccc(COc3cccc(c3)C3(CO)CCOCC3)cc2ccc1=O
Show InChI InChI=1S/C23H25NO4/c1-24-21-7-5-17(13-18(21)6-8-22(24)26)15-28-20-4-2-3-19(14-20)23(16-25)9-11-27-12-10-23/h2-8,13-14,25H,9-12,15-16H2,1H3
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n/an/a 2.30E+3n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043672
PNG
(6-[3-Fluoro-5-((R)-1-methoxy-1-thiazol-2-yl-propyl...)
Show SMILES CC[C@](OC)(c1nccs1)c1cc(F)cc(OCc2ccc3n(C)c(=O)ccc3c2)c1
Show InChI InChI=1S/C24H23FN2O3S/c1-4-24(29-3,23-26-9-10-31-23)18-12-19(25)14-20(13-18)30-15-16-5-7-21-17(11-16)6-8-22(28)27(21)2/h5-14H,4,15H2,1-3H3/t24-/m1/s1
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n/an/a 4.50E+3n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50007054
PNG
(5-{1-Methoxy-1-[3-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES CCC(OC)(c1cncs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H23NO2S/c1-3-24(26-2,23-15-25-17-28-23)21-9-6-10-22(14-21)27-16-18-11-12-19-7-4-5-8-20(19)13-18/h4-15,17H,3,16H2,1-2H3
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n/an/a 6.30E+3n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043680
PNG
(4-[3-(1-Methyl-2-oxo-1,2-dihydro-quinolin-6-ylmeth...)
Show SMILES Cn1c2ccc(COc3cccc(c3)C3(CCOCC3)C=O)cc2ccc1=O
Show InChI InChI=1S/C23H23NO4/c1-24-21-7-5-17(13-18(21)6-8-22(24)26)15-28-20-4-2-3-19(14-20)23(16-25)9-11-27-12-10-23/h2-8,13-14,16H,9-12,15H2,1H3
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n/an/a 9.90E+3n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043673
PNG
(2-{(R)-1-[3-Fluoro-5-(naphthalen-2-ylmethoxy)-phen...)
Show SMILES CC[C@](OC)(c1nccs1)c1cc(F)cc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H22FNO2S/c1-3-24(27-2,23-26-10-11-29-23)20-13-21(25)15-22(14-20)28-16-17-8-9-18-6-4-5-7-19(18)12-17/h4-15H,3,16H2,1-2H3/t24-/m1/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50007045
PNG
(2-[1-Methoxy-4-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2c1cccc2OCc1ccc2ccccc2c1)c1nccs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-25-13-14-28-23)12-11-20-21(24)7-4-8-22(20)27-16-17-9-10-18-5-2-3-6-19(18)15-17/h2-10,13-15H,11-12,16H2,1H3
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n/an/a>4.00E+4n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50007040
PNG
(2-[1-Methoxy-6-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2ccc(OCc3ccc4ccccc4c3)cc12)c1nccs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-25-12-13-28-23)11-10-19-8-9-21(15-22(19)24)27-16-17-6-7-18-4-2-3-5-20(18)14-17/h2-9,12-15H,10-11,16H2,1H3
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n/an/a>4.00E+4n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50007061
PNG
(2-[6-(Naphthalen-2-ylmethoxy)-indan-1-yl]-thiazole...)
Show SMILES C(Oc1ccc2CCC(c3nccs3)c2c1)c1ccc2ccccc2c1
Show InChI InChI=1S/C23H19NOS/c1-2-4-19-13-16(5-6-17(19)3-1)15-25-20-9-7-18-8-10-21(22(18)14-20)23-24-11-12-26-23/h1-7,9,11-14,21H,8,10,15H2
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n/an/a>4.00E+4n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50000826
PNG
(2-{1-Methoxy-1-[2-methyl-5-(naphthalen-2-ylmethoxy...)
Show SMILES COC(C)(c1nccs1)c1cc(OCc2ccc3ccccc3c2)ccc1C
Show InChI InChI=1S/C24H23NO2S/c1-17-8-11-21(15-22(17)24(2,26-3)23-25-12-13-28-23)27-16-18-9-10-19-6-4-5-7-20(19)14-18/h4-15H,16H2,1-3H3
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n/an/a 4.00E+4n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50043675
PNG
(5-[1-Methoxy-6-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2ccc(OCc3ccc4ccccc4c3)cc12)c1cncs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-14-25-16-28-23)11-10-19-8-9-21(13-22(19)24)27-15-17-6-7-18-4-2-3-5-20(18)12-17/h2-9,12-14,16H,10-11,15H2,1H3
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n/an/a>4.00E+4n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50007046
PNG
(2-(3-Methoxy-indan-5-yloxymethyl)-naphthalene | CH...)
Show SMILES COC1CCc2ccc(OCc3ccc4ccccc4c3)cc12
Show InChI InChI=1S/C21H20O2/c1-22-21-11-9-17-8-10-19(13-20(17)21)23-14-15-6-7-16-4-2-3-5-18(16)12-15/h2-8,10,12-13,21H,9,11,14H2,1H3
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n/an/a>4.00E+4n/an/an/an/an/an/a



Centre de Recherches

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase from human whole blood


J Med Chem 37: 113-24 (1994)


BindingDB Entry DOI: 10.7270/Q2JW8CZP
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%