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Found 234 hits Enz. Inhib. hit(s) with Target = 'Lipoxygenase (LOX)'   
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
Lipoxygenase-1


(Glycine max (soybean))
BDBM192765
PNG
(1,3-Dimethoxy-5-methyl-2-((2E,6E)-3,7,11-trimethyl...)
Show SMILES COc1cc(C)cc(OC)c1C\C=C(/C)CC\C=C(/C)CCC=C(C)C
Show InChI InChI=1S/C24H36O2/c1-18(2)10-8-11-19(3)12-9-13-20(4)14-15-22-23(25-6)16-21(5)17-24(22)26-7/h10,12,14,16-17H,8-9,11,13,15H2,1-7H3/b19-12+,20-14+
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PubMed
n/an/a 520n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192758
PNG
(1-Allyl-2,4-dimethoxybenzene (4) | 1-Allyl-2,4-dim...)
Show SMILES COc1ccc(CC=C)c(OC)c1
Show InChI InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)8-11(9)13-3/h4,6-8H,1,5H2,2-3H3
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n/an/a 3.14E+4n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192763
PNG
(1,3-Dimethoxy-5-methyl-2-(3-methylbut-2-en-1-yl)be...)
Show SMILES COc1cc(C)cc(OC)c1CC=C(C)C
Show InChI InChI=1S/C14H20O2/c1-10(2)6-7-12-13(15-4)8-11(3)9-14(12)16-5/h6,8-9H,7H2,1-5H3
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n/an/a 7.60E+3n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192762
PNG
(2-Allyl-1,3-dimethoxy-5-methylbenzene (8))
Show SMILES COc1cc(C)cc(OC)c1CC=C
Show InChI InChI=1S/C12H16O2/c1-5-6-10-11(13-3)7-9(2)8-12(10)14-4/h5,7-8H,1,6H2,2-4H3
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n/an/a 3.05E+4n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192761
PNG
(2-Allyl-1,3,5-trimethoxybenzene (7))
Show SMILES COc1cc(OC)c(CC=C)c(OC)c1
Show InChI InChI=1S/C12H16O3/c1-5-6-10-11(14-3)7-9(13-2)8-12(10)15-4/h5,7-8H,1,6H2,2-4H3
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n/an/a 8.32E+4n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192760
PNG
(2-Allyl-1,3-dimethoxybenzene (6))
Show SMILES COc1cccc(OC)c1CC=C
Show InChI InChI=1S/C11H14O2/c1-4-6-9-10(12-2)7-5-8-11(9)13-3/h4-5,7-8H,1,6H2,2-3H3
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n/an/a 5.32E+4n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192758
PNG
(1-Allyl-2,4-dimethoxybenzene (4) | 1-Allyl-2,4-dim...)
Show SMILES COc1ccc(CC=C)c(OC)c1
Show InChI InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)8-11(9)13-3/h4,6-8H,1,5H2,2-3H3
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PubMed
n/an/a 1.03E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192766
PNG
(4-MMPB)
Show SMILES CN1CCN(CC1)c1nc(C)c2Nc3ccccc3Sc2n1
Show InChI InChI=1S/C16H19N5S/c1-11-14-15(22-13-6-4-3-5-12(13)18-14)19-16(17-11)21-9-7-20(2)8-10-21/h3-6,18H,7-10H2,1-2H3
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n/an/a 2.26E+4n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111805
PNG
(2,6-Bis[4-(methylaminoethanol)benzylidine] cyclohe...)
Show SMILES CNC(CO)c1ccc(\C=C2/CCC\C(=C/c3ccc(cc3)C(CO)NC)C2=O)cc1
Show InChI InChI=1S/C26H32N2O3/c1-27-24(16-29)20-10-6-18(7-11-20)14-22-4-3-5-23(26(22)31)15-19-8-12-21(13-9-19)25(17-30)28-2/h6-15,24-25,27-30H,3-5,16-17H2,1-2H3/b22-14+,23-15+
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n/an/a 8.24E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111807
PNG
(2,6-Bis(2,3-dimethoxybenzylidene)cyclohexanone (3))
Show SMILES COc1cccc(\C=C2/CCC\C(=C/c3cccc(OC)c3OC)C2=O)c1OC
Show InChI InChI=1S/C24H26O5/c1-26-20-12-6-10-18(23(20)28-3)14-16-8-5-9-17(22(16)25)15-19-11-7-13-21(27-2)24(19)29-4/h6-7,10-15H,5,8-9H2,1-4H3/b16-14+,17-15+
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n/an/a 4.78E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111809
PNG
(2,6-Bis[2-methyl-4(N-ethyl-N-ethylacetonitrile) an...)
Show SMILES CCN(CC)C(C#C)c1ccc(\C=C2/CCC\C(=C/c3ccc(cc3C)C(C#C)N(CC)CC)C2=O)c(C)c1
Show InChI InChI=1S/C36H44N2O/c1-9-34(37(11-3)12-4)30-20-18-28(26(7)22-30)24-32-16-15-17-33(36(32)39)25-29-19-21-31(23-27(29)8)35(10-2)38(13-5)14-6/h1-2,18-25,34-35H,11-17H2,3-8H3/b32-24+,33-25+
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n/an/a 3.00E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111810
PNG
((1Z,4Z)-1,5-Bis [4-(methylaminoethanol)phenyl]- 1,...)
Show SMILES CNC(CO)c1ccc(\C=C\C(=O)\C=C\c2ccc(cc2)C(CO)NC)cc1
Show InChI InChI=1S/C23H28N2O3/c1-24-22(15-26)19-9-3-17(4-10-19)7-13-21(28)14-8-18-5-11-20(12-6-18)23(16-27)25-2/h3-14,22-27H,15-16H2,1-2H3/b13-7+,14-8+
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n/an/a 5.64E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111811
PNG
((1Z,4Z)–1-5-Bis[2,3(dimethoxy)phenyl]-1,4- pe...)
Show SMILES COc1cccc(\C=C\C(=O)\C=C\c2cccc(OC)c2OC)c1OC
Show InChI InChI=1S/C21H22O5/c1-23-18-9-5-7-15(20(18)25-3)11-13-17(22)14-12-16-8-6-10-19(24-2)21(16)26-4/h5-14H,1-4H3/b13-11+,14-12+
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PubMed
n/an/a 6.29E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111812
PNG
((1E,4E)‐1,5‐bis[4‐(diethylamino)...)
Show SMILES CCN(CC)c1ccc(\C=C\C(=O)\C=C\c2ccc(cc2)N(CC)CC)cc1
Show InChI InChI=1S/C25H32N2O/c1-5-26(6-2)23-15-9-21(10-16-23)13-19-25(28)20-14-22-11-17-24(18-12-22)27(7-3)8-4/h9-20H,5-8H2,1-4H3/b19-13+,20-14+
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n/an/a 9.51E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111813
PNG
((1E,4E)-1,5-Bis[2-methyl-4(N-ethyl-Nethylacetonitr...)
Show SMILES CCN(CC)C(C#N)c1ccc(\C=C\C(=O)\C=C\c2ccc(cc2C)C(C#N)N(CC)CC)c(C)c1
Show InChI InChI=1S/C31H38N4O/c1-7-34(8-2)30(21-32)27-13-11-25(23(5)19-27)15-17-29(36)18-16-26-12-14-28(20-24(26)6)31(22-33)35(9-3)10-4/h11-20,30-31H,7-10H2,1-6H3/b17-15+,18-16+
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n/an/a 4.11E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111814
PNG
(2,5-Bis[4-(methylaminoethanol)benzylidene] cyclope...)
Show SMILES CNC(CO)c1ccc(\C=C2/CC\C(=C/c3ccc(cc3)C(CO)NC)C2=O)cc1
Show InChI InChI=1S/C25H30N2O3/c1-26-23(15-28)19-7-3-17(4-8-19)13-21-11-12-22(25(21)30)14-18-5-9-20(10-6-18)24(16-29)27-2/h3-10,13-14,23-24,26-29H,11-12,15-16H2,1-2H3/b21-13+,22-14+
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n/an/a 8.95E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111816
PNG
((2E,5E)‐2,5‐bis[(2,3‐ dimethoxyp...)
Show SMILES COc1cccc(\C=C2/CC\C(=C/c3cccc(OC)c3OC)C2=O)c1OC
Show InChI InChI=1S/C23H24O5/c1-25-19-9-5-7-17(22(19)27-3)13-15-11-12-16(21(15)24)14-18-8-6-10-20(26-2)23(18)28-4/h5-10,13-14H,11-12H2,1-4H3/b15-13+,16-14+
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n/an/a 6.38E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM111817
PNG
(2,5-Bis(4-diethylaminobenzylidene)cyclopentanone (...)
Show SMILES CCN(CC)c1ccc(\C=C2/CC\C(=C/c3ccc(cc3)N(CC)CC)C2=O)cc1
Show InChI InChI=1S/C27H34N2O/c1-5-28(6-2)25-15-9-21(10-16-25)19-23-13-14-24(27(23)30)20-22-11-17-26(18-12-22)29(7-3)8-4/h9-12,15-20H,5-8,13-14H2,1-4H3/b23-19+,24-20+
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n/an/a 5.68E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM29532
PNG
((1E,6E)-1,7-bis(3-methoxy-4-oxidanyl-phenyl)hepta-...)
Show SMILES COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O
Show InChI InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3
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n/an/a 5.78E+4n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase (LOX)


(Glycine max (Soybean))
BDBM32020
PNG
(4-[4-(3,4-dihydroxyphenyl)-2,3-dimethyl-butyl]pyro...)
Show SMILES CC(Cc1ccc(O)c(O)c1)C(C)Cc1ccc(O)c(O)c1
Show InChI InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3
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PubMed
n/an/a 9.23E+3n/an/an/an/a7.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz, 50300, Kuala Lumpur, Malaysia



Assay Description
The assay was progressed in 96-well microliter plates containing substrate, soybean LOX enzyme, and respective test substance at room temperature in ...


Chem Biol Drug Des 83: 670-81 (2014)


Article DOI: 10.1111/cbdd.12280
BindingDB Entry DOI: 10.7270/Q26H4G2V
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152742
PNG
(3,5-bis((5-bromo-6-methyl-2-morpholinopyrimidin-4-...)
Show SMILES Cc1nc(nc(Sc2nnc(Sc3nc(nc(C)c3Br)N3CCOCC3)n2N)c1Br)N1CCOCC1
Show InChI InChI=1S/C20H24Br2N10O2S2/c1-11-13(21)15(26-17(24-11)30-3-7-33-8-4-30)35-19-28-29-20(32(19)23)36-16-14(22)12(2)25-18(27-16)31-5-9-34-10-6-31/h3-10,23H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152743
PNG
(3,5-bis((5-bromo-6-methyl-2-(piperidin-1-yl)pyrimi...)
Show SMILES Cc1nc(nc(Sc2nnc(Sc3nc(nc(C)c3Br)N3CCCCC3)n2N)c1Br)N1CCCCC1
Show InChI InChI=1S/C22H28Br2N10S2/c1-13-15(23)17(28-19(26-13)32-9-5-3-6-10-32)35-21-30-31-22(34(21)25)36-18-16(24)14(2)27-20(29-18)33-11-7-4-8-12-33/h3-12,25H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152744
PNG
(3,5-bis((5-bromo-6-methyl-2-(4-methylpiperidin-1-y...)
Show SMILES CC1CCN(CC1)c1nc(C)c(Br)c(Sc2nnc(Sc3nc(nc(C)c3Br)N3CCC(C)CC3)n2N)n1
Show InChI InChI=1S/C24H32Br2N10S2/c1-13-5-9-34(10-6-13)21-28-15(3)17(25)19(30-21)37-23-32-33-24(36(23)27)38-20-18(26)16(4)29-22(31-20)35-11-7-14(2)8-12-35/h13-14H,5-12,27H2,1-4H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152745
PNG
(3,5-bis((5-bromo-6-methyl-2-(4-methylpiperazin-1-y...)
Show SMILES CN1CCN(CC1)c1nc(C)c(Br)c(Sc2nnc(Sc3nc(nc(C)c3Br)N3CCN(C)CC3)n2N)n1
Show InChI InChI=1S/C22H30Br2N12S2/c1-13-15(23)17(28-19(26-13)34-9-5-32(3)6-10-34)37-21-30-31-22(36(21)25)38-18-16(24)14(2)27-20(29-18)35-11-7-33(4)8-12-35/h5-12,25H2,1-4H3
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n/an/a 9.00E+3n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152746
PNG
(3,5-bis((5-bromo-6-methyl-2-(4-phenylpiperazin-1-y...)
Show SMILES Cc1nc(nc(Sc2nnc(Sc3nc(nc(C)c3Br)N3CCN(CC3)c3ccccc3)n2N)c1Br)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C32H34Br2N12S2/c1-21-25(33)27(38-29(36-21)44-17-13-42(14-18-44)23-9-5-3-6-10-23)47-31-40-41-32(46(31)35)48-28-26(34)22(2)37-30(39-28)45-19-15-43(16-20-45)24-11-7-4-8-12-24/h3-12H,13-20,35H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152747
PNG
(3,5-bis((5-bromo-6-methyl-2-(4-ethylpiperazin-1-yl...)
Show SMILES CCN1CCN(CC1)c1nc(C)c(Br)c(Sc2nnc(Sc3nc(nc(C)c3Br)N3CCN(CC)CC3)n2N)n1
Show InChI InChI=1S/C24H34Br2N12S2/c1-5-34-7-11-36(12-8-34)21-28-15(3)17(25)19(30-21)39-23-32-33-24(38(23)27)40-20-18(26)16(4)29-22(31-20)37-13-9-35(6-2)10-14-37/h5-14,27H2,1-4H3
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n/an/a 1.20E+4n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152748
PNG
(3,5-bis((5-bromo-6-methyl-2-(pyrrolidin-1-yl)pyrim...)
Show SMILES Cc1nc(nc(Sc2nnc(Sc3nc(nc(C)c3Br)N3CCCC3)n2N)c1Br)N1CCCC1
Show InChI InChI=1S/C20H24Br2N10S2/c1-11-13(21)15(26-17(24-11)30-7-3-4-8-30)33-19-28-29-20(32(19)23)34-16-14(22)12(2)25-18(27-16)31-9-5-6-10-31/h3-10,23H2,1-2H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152749
PNG
(4-(5-bromo-4-methyl-6-((6-methyl-8-morpholino-5H-p...)
Show SMILES Cc1nc(nc(Sc2nnc3Sc4nc(nc(C)c4Nn23)N2CCOCC2)c1C)N1CCOCC1
Show InChI InChI=1S/C21H26N10O2S2/c1-12-13(2)22-18(29-4-8-32-9-5-29)24-16(12)34-20-26-27-21-31(20)28-15-14(3)23-19(25-17(15)35-21)30-6-10-33-11-7-30/h28H,4-11H2,1-3H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152750
PNG
(3-((5-bromo-6-methyl-2-(piperidin-1-yl)pyrimidin-4...)
Show SMILES Cc1nc(nc(Sc2nnc3Sc4nc(nc(C)c4Nn23)N2CCCCC2)c1C)N1CCCCC1
Show InChI InChI=1S/C23H30N10S2/c1-14-15(2)24-20(31-10-6-4-7-11-31)26-18(14)34-22-28-29-23-33(22)30-17-16(3)25-21(27-19(17)35-23)32-12-8-5-9-13-32/h30H,4-13H2,1-3H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152751
PNG
(3-((5-bromo-6-methyl-2-(4-methylpiperidin-1-yl)pyr...)
Show SMILES CC1CCN(CC1)c1nc(C)c(C)c(Sc2nnc3Sc4nc(nc(C)c4Nn23)N2CCC(C)CC2)n1
Show InChI InChI=1S/C25H34N10S2/c1-14-6-10-33(11-7-14)22-26-17(4)16(3)20(28-22)36-24-30-31-25-35(24)32-19-18(5)27-23(29-21(19)37-25)34-12-8-15(2)9-13-34/h14-15,32H,6-13H2,1-5H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152752
PNG
(3-((5-bromo-6-methyl-2-(4-methylpiperazin-1-yl)pyr...)
Show SMILES CN1CCN(CC1)c1nc(C)c(C)c(Sc2nnc3Sc4nc(nc(C)c4Nn23)N2CCN(C)CC2)n1
Show InChI InChI=1S/C23H32N12S2/c1-14-15(2)24-20(33-10-6-31(4)7-11-33)26-18(14)36-22-28-29-23-35(22)30-17-16(3)25-21(27-19(17)37-23)34-12-8-32(5)9-13-34/h30H,6-13H2,1-5H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152753
PNG
(3-((5-bromo-6-methyl-2-(4-phenylpiperazin-1-yl)pyr...)
Show SMILES Cc1nc(nc(Sc2nnc3Sc4nc(nc(C)c4Nn23)N2CCN(CC2)c2ccccc2)c1C)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C33H36N12S2/c1-22-23(2)34-30(43-18-14-41(15-19-43)25-10-6-4-7-11-25)36-28(22)46-32-38-39-33-45(32)40-27-24(3)35-31(37-29(27)47-33)44-20-16-42(17-21-44)26-12-8-5-9-13-26/h4-13,40H,14-21H2,1-3H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152754
PNG
(3-((5-bromo-2-(4-ethylpiperazin-1-yl)-6-methylpyri...)
Show SMILES CCN1CCN(CC1)c1nc(C)c(C)c(Sc2nnc3Sc4nc(nc(C)c4Nn23)N2CCN(CC)CC2)n1
Show InChI InChI=1S/C25H36N12S2/c1-6-33-8-12-35(13-9-33)22-26-17(4)16(3)20(28-22)38-24-30-31-25-37(24)32-19-18(5)27-23(29-21(19)39-25)36-14-10-34(7-2)11-15-36/h32H,6-15H2,1-5H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM152755
PNG
(3-((5-bromo-6-methyl-2-(pyrrolidin-1-yl)pyrimidin-...)
Show SMILES Cc1nc(nc(Sc2nnc3Sc4nc(nc(C)c4Nn23)N2CCCC2)c1C)N1CCCC1
Show InChI InChI=1S/C21H26N10S2/c1-12-13(2)22-18(29-8-4-5-9-29)24-16(12)32-20-26-27-21-31(20)28-15-14(3)23-19(25-17(15)33-21)30-10-6-7-11-30/h28H,4-11H2,1-3H3
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n/an/a>5.00E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Linoleic acid and two assay solutions (A and B) were prepared in advance. Solution A was 50 mM 3-(dimethylamino)benzoic acid (DMAB) in a 100 mM phosp...


Chem Biol Drug Des 85: 216-24 (2015)


Article DOI: 10.1111/cbdd.12375
BindingDB Entry DOI: 10.7270/Q2ST7NK5
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM50379791
PNG
(METHYLEUGENOL | Methyl eugenol (1))
Show SMILES COc1ccc(CC=C)cc1OC
Show InChI InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3
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n/an/a 3.33E+4n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192756
PNG
(1-Allyl-3,5-dimethoxybenzene (2))
Show SMILES COc1cc(CC=C)cc(OC)c1
Show InChI InChI=1S/C11H14O2/c1-4-5-9-6-10(12-2)8-11(7-9)13-3/h4,6-8H,1,5H2,2-3H3
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n/an/a 4.32E+4n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192757
PNG
(1,2-dimethoxy-3-(prop-2-en-1-yl)benzene (3) | Meth...)
Show SMILES COc1cccc(CC=C)c1OC
Show InChI InChI=1S/C11H14O2/c1-4-6-9-7-5-8-10(12-2)11(9)13-3/h4-5,7-8H,1,6H2,2-3H3
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n/an/a 1.29E+5n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM192764
PNG
((E)-2-(3,7-Dimethylocta-2,6-dien-1-yl)-1,3-dimetho...)
Show SMILES COc1cc(C)cc(OC)c1C\C=C(/C)CCC=C(C)C
Show InChI InChI=1S/C19H28O2/c1-14(2)8-7-9-15(3)10-11-17-18(20-5)12-16(4)13-19(17)21-6/h8,10,12-13H,7,9,11H2,1-6H3/b15-10+
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n/an/a 5.30E+3n/an/an/an/a7.025



Ferdowsi University of Mashhad



Assay Description
Solution A was 50 mm DMAB in an 100 mm phosphate buffer (pH 7.0). Solution B was a mixture of 10 mm MBTH (3 mL) and hemoglobin (5 mg/mL, 3 mL) in 50 ...


Chem Biol Drug Des 88: 460-9 (2016)


Article DOI: 10.1111/cbdd.12779
BindingDB Entry DOI: 10.7270/Q2TT4PSF
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM22343
PNG
((5E)-5-[(2-chlorophenyl)methylidene]-2-(1,3-thiazo...)
Show SMILES Clc1ccccc1C=C1SC(Nc2nccs2)=NC1=O
Show InChI InChI=1S/C13H8ClN3OS2/c14-9-4-2-1-3-8(9)7-10-11(18)16-13(20-10)17-12-15-5-6-19-12/h1-7H,(H,15,16,17,18)
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n/an/a 1.15E+5n/an/an/an/a7.428



Aristotle University



Assay Description
The tested compounds were added to the reaction mixture with soybean lipoxygenase. Enzyme reaction was initiated by the addition of sodium linoleate ...


J Med Chem 51: 1601-9 (2008)


Article DOI: 10.1021/jm701496h
BindingDB Entry DOI: 10.7270/Q2JM27XJ
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM22342
PNG
((5E)-5-[(3-chlorophenyl)methylidene]-2-(1,3-thiazo...)
Show SMILES Clc1cccc(C=C2SC(Nc3nccs3)=NC2=O)c1
Show InChI InChI=1S/C13H8ClN3OS2/c14-9-3-1-2-8(6-9)7-10-11(18)16-13(20-10)17-12-15-4-5-19-12/h1-7H,(H,15,16,17,18)
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n/an/a 1.26E+5n/an/an/an/a7.428



Aristotle University



Assay Description
The tested compounds were added to the reaction mixture with soybean lipoxygenase. Enzyme reaction was initiated by the addition of sodium linoleate ...


J Med Chem 51: 1601-9 (2008)


Article DOI: 10.1021/jm701496h
BindingDB Entry DOI: 10.7270/Q2JM27XJ
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM22341
PNG
((5E)-5-[(4-chlorophenyl)methylidene]-2-(1,3-thiazo...)
Show SMILES Clc1ccc(C=C2SC(Nc3nccs3)=NC2=O)cc1
Show InChI InChI=1S/C13H8ClN3OS2/c14-9-3-1-8(2-4-9)7-10-11(18)16-13(20-10)17-12-15-5-6-19-12/h1-7H,(H,15,16,17,18)
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n/an/a 1.20E+5n/an/an/an/a7.428



Aristotle University



Assay Description
The tested compounds were added to the reaction mixture with soybean lipoxygenase. Enzyme reaction was initiated by the addition of sodium linoleate ...


J Med Chem 51: 1601-9 (2008)


Article DOI: 10.1021/jm701496h
BindingDB Entry DOI: 10.7270/Q2JM27XJ
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM22340
PNG
((5E)-5-[(3-nitrophenyl)methylidene]-2-(1,3-thiazol...)
Show SMILES [O-][N+](=O)c1cccc(C=C2SC(Nc3nccs3)=NC2=O)c1
Show InChI InChI=1S/C13H8N4O3S2/c18-11-10(7-8-2-1-3-9(6-8)17(19)20)22-13(15-11)16-12-14-4-5-21-12/h1-7H,(H,14,15,16,18)
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n/an/a 8.91E+4n/an/an/an/a7.428



Aristotle University



Assay Description
The tested compounds were added to the reaction mixture with soybean lipoxygenase. Enzyme reaction was initiated by the addition of sodium linoleate ...


J Med Chem 51: 1601-9 (2008)


Article DOI: 10.1021/jm701496h
BindingDB Entry DOI: 10.7270/Q2JM27XJ
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM22339
PNG
((5E)-5-[(4-nitrophenyl)methylidene]-2-(1,3-thiazol...)
Show SMILES [O-][N+](=O)c1ccc(C=C2SC(Nc3nccs3)=NC2=O)cc1
Show InChI InChI=1S/C13H8N4O3S2/c18-11-10(7-8-1-3-9(4-2-8)17(19)20)22-13(15-11)16-12-14-5-6-21-12/h1-7H,(H,14,15,16,18)
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n/an/a 2.51E+5n/an/an/an/a7.428



Aristotle University



Assay Description
The tested compounds were added to the reaction mixture with soybean lipoxygenase. Enzyme reaction was initiated by the addition of sodium linoleate ...


J Med Chem 51: 1601-9 (2008)


Article DOI: 10.1021/jm701496h
BindingDB Entry DOI: 10.7270/Q2JM27XJ
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM22338
PNG
((5E)-5-[(4-methoxyphenyl)methylidene]-2-(1,3-thiaz...)
Show SMILES COc1ccc(C=C2SC(Nc3nccs3)=NC2=O)cc1
Show InChI InChI=1S/C14H11N3O2S2/c1-19-10-4-2-9(3-5-10)8-11-12(18)16-14(21-11)17-13-15-6-7-20-13/h2-8H,1H3,(H,15,16,17,18)
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n/an/a 1.22E+5n/an/an/an/a7.428



Aristotle University



Assay Description
The tested compounds were added to the reaction mixture with soybean lipoxygenase. Enzyme reaction was initiated by the addition of sodium linoleate ...


J Med Chem 51: 1601-9 (2008)


Article DOI: 10.1021/jm701496h
BindingDB Entry DOI: 10.7270/Q2JM27XJ
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM22335
PNG
((5E)-5-[(4-hydroxyphenyl)methylidene]-2-(1,3-thiaz...)
Show SMILES Oc1ccc(C=C2SC(Nc3nccs3)=NC2=O)cc1
Show InChI InChI=1S/C13H9N3O2S2/c17-9-3-1-8(2-4-9)7-10-11(18)15-13(20-10)16-12-14-5-6-19-12/h1-7,17H,(H,14,15,16,18)
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n/an/a 1.16E+5n/an/an/an/a7.428



Aristotle University



Assay Description
The tested compounds were added to the reaction mixture with soybean lipoxygenase. Enzyme reaction was initiated by the addition of sodium linoleate ...


J Med Chem 51: 1601-9 (2008)


Article DOI: 10.1021/jm701496h
BindingDB Entry DOI: 10.7270/Q2JM27XJ
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM22337
PNG
((5E)-5-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-...)
Show SMILES COc1cc(C=C2SC(Nc3nccs3)=NC2=O)ccc1O
Show InChI InChI=1S/C14H11N3O3S2/c1-20-10-6-8(2-3-9(10)18)7-11-12(19)16-14(22-11)17-13-15-4-5-21-13/h2-7,18H,1H3,(H,15,16,17,19)
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n/an/a 9.95E+4n/an/an/an/a7.428



Aristotle University



Assay Description
The tested compounds were added to the reaction mixture with soybean lipoxygenase. Enzyme reaction was initiated by the addition of sodium linoleate ...


J Med Chem 51: 1601-9 (2008)


Article DOI: 10.1021/jm701496h
BindingDB Entry DOI: 10.7270/Q2JM27XJ
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM222268
PNG
(2-Methyl-4-(2-oxo-2-phenyl-ethyl)-5-phenyl-furan-3...)
Show SMILES COC(=O)c1c(C)oc(c1CC(=O)c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C21H18O4/c1-14-19(21(23)24-2)17(13-18(22)15-9-5-3-6-10-15)20(25-14)16-11-7-4-8-12-16/h3-12H,13H2,1-2H3
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n/an/a 7.85E+4n/an/an/an/a8.0n/a



CSIR - Indian Institute of Chemical Biology



Assay Description
SLO inhibition was studied by spectrophotometric assay by measuring the change in the absorbance at 234 nm due to formation of hydroperoxylinoleic ac...


Bioorg Chem 71: 97-101 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.016
BindingDB Entry DOI: 10.7270/Q2F76BCD
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM222269
PNG
(2-Methyl-4-(2-oxo-2-phenyl-ethyl)-5-phenyl-furan-3...)
Show SMILES CCOC(=O)c1c(C)oc(c1CC(=O)c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C22H20O4/c1-3-25-22(24)20-15(2)26-21(17-12-8-5-9-13-17)18(20)14-19(23)16-10-6-4-7-11-16/h4-13H,3,14H2,1-2H3
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n/an/a 2.87E+5n/an/an/an/a8.0n/a



CSIR - Indian Institute of Chemical Biology



Assay Description
SLO inhibition was studied by spectrophotometric assay by measuring the change in the absorbance at 234 nm due to formation of hydroperoxylinoleic ac...


Bioorg Chem 71: 97-101 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.016
BindingDB Entry DOI: 10.7270/Q2F76BCD
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM222270
PNG
(Methyl 2-methyl-5-(4-methylphenyl)-4-[2-(4-methylp...)
Show SMILES COC(=O)c1c(C)oc(c1CC(=O)c1ccc(C)cc1)-c1ccc(C)cc1
Show InChI InChI=1S/C23H22O4/c1-14-5-9-17(10-6-14)20(24)13-19-21(23(25)26-4)16(3)27-22(19)18-11-7-15(2)8-12-18/h5-12H,13H2,1-4H3
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n/an/a 2.21E+4n/an/an/an/a8.0n/a



CSIR - Indian Institute of Chemical Biology



Assay Description
SLO inhibition was studied by spectrophotometric assay by measuring the change in the absorbance at 234 nm due to formation of hydroperoxylinoleic ac...


Bioorg Chem 71: 97-101 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.016
BindingDB Entry DOI: 10.7270/Q2F76BCD
More data for this
Ligand-Target Pair
Lipoxygenase-1


(Glycine max (soybean))
BDBM222271
PNG
(2-Methyl-4-(2-oxo-2-p-tolyl-ethyl)-5-p-tolyl-furan...)
Show SMILES CCOC(=O)c1c(C)oc(c1CC(=O)c1ccc(C)cc1)-c1ccc(C)cc1
Show InChI InChI=1S/C24H24O4/c1-5-27-24(26)22-17(4)28-23(19-12-8-16(3)9-13-19)20(22)14-21(25)18-10-6-15(2)7-11-18/h6-13H,5,14H2,1-4H3
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n/an/a 2.26E+4n/an/an/an/a8.0n/a



CSIR - Indian Institute of Chemical Biology



Assay Description
SLO inhibition was studied by spectrophotometric assay by measuring the change in the absorbance at 234 nm due to formation of hydroperoxylinoleic ac...


Bioorg Chem 71: 97-101 (2017)


Article DOI: 10.1016/j.bioorg.2017.01.016
BindingDB Entry DOI: 10.7270/Q2F76BCD
More data for this
Ligand-Target Pair
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