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PubMed code 26197161

Compile data set for download or QSAR
Found 40 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


(Homo sapiens (Human))
BDBM50116890
PNG
(CHEMBL3613038)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCc2cnnn2CCCOC(=O)C2(C)CCc3c(C)c(OC(C)=O)c(C)c(C)c3O2)cc1OC(C)=O
Show InChI InChI=1S/C36H41N3O11/c1-21-22(2)34-29(23(3)33(21)49-26(6)42)13-15-36(7,50-34)35(44)46-17-8-16-39-28(20-37-38-39)14-18-45-32(43)12-10-27-9-11-30(47-24(4)40)31(19-27)48-25(5)41/h9-12,19-20H,8,13-18H2,1-7H3/b12-10+
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n/an/a 160n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116902
PNG
(CHEMBL3613026)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCCCCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C23H28O6/c1-4-5-6-7-8-9-10-11-16-27-23(26)15-13-20-12-14-21(28-18(2)24)22(17-20)29-19(3)25/h1,12-15,17H,5-11,16H2,2-3H3/b15-13+
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n/an/a 180n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116895
PNG
(CHEMBL3613033)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCCCCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C26H35N3O7/c1-20(31)35-24-13-11-22(18-25(24)36-21(2)32)12-14-26(33)34-17-8-6-4-3-5-7-10-23-19-27-28-29(23)15-9-16-30/h11-14,18-19,30H,3-10,15-17H2,1-2H3/b14-12+
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n/an/a 200n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116903
PNG
(CHEMBL3613025)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C20H22O6/c1-4-5-6-7-8-13-24-20(23)12-10-17-9-11-18(25-15(2)21)19(14-17)26-16(3)22/h1,9-12,14H,5-8,13H2,2-3H3/b12-10+
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n/an/a 470n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50000541
PNG
((+-)-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)
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n/an/a 540n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116891
PNG
(CHEMBL3613037)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCn2cc(CCOC(=O)\C=C\c3ccc(OC(C)=O)c(OC(C)=O)c3)nn2)cc1OC(C)=O
Show InChI InChI=1S/C33H33N3O12/c1-21(37)45-28-10-6-25(18-30(28)47-23(3)39)8-12-32(41)43-16-5-15-36-20-27(34-35-36)14-17-44-33(42)13-9-26-7-11-29(46-22(2)38)31(19-26)48-24(4)40/h6-13,18-20H,5,14-17H2,1-4H3/b12-8+,13-9+
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n/an/a 600n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116904
PNG
(CHEMBL3613024)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C19H20O6/c1-4-5-6-7-12-23-19(22)11-9-16-8-10-17(24-14(2)20)18(13-16)25-15(3)21/h1,8-11,13H,5-7,12H2,2-3H3/b11-9+
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n/an/a 920n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116899
PNG
(CHEMBL3613029)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)CCCN=[N+]=[N-])cc1OC(C)=O
Show InChI InChI=1S/C16H17N3O5/c1-11(20)23-15-8-6-13(10-16(15)24-12(2)21)5-7-14(22)4-3-9-18-19-17/h5-8,10H,3-4,9H2,1-2H3/b7-5+
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n/an/a 1.30E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50000541
PNG
((+-)-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)
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n/an/a 1.30E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116905
PNG
(CHEMBL3613023)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C17H16O6/c1-4-5-10-21-17(20)9-7-14-6-8-15(22-12(2)18)16(11-14)23-13(3)19/h1,6-9,11H,5,10H2,2-3H3/b9-7+
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n/an/a 1.80E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116889
PNG
(CHEMBL3613039)
Show SMILES CC(=O)Oc1c(C)c(C)c2OC(C)(CCc2c1C)C(=O)OCCCN=[N+]=[N-]
Show InChI InChI=1S/C19H25N3O5/c1-11-12(2)17-15(13(3)16(11)26-14(4)23)7-8-19(5,27-17)18(24)25-10-6-9-21-22-20/h6-10H2,1-5H3
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n/an/a 2.60E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116896
PNG
(CHEMBL3613032)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C23H29N3O7/c1-17(28)32-21-10-8-19(15-22(21)33-18(2)29)9-11-23(30)31-14-5-3-4-7-20-16-24-25-26(20)12-6-13-27/h8-11,15-16,27H,3-7,12-14H2,1-2H3/b11-9+
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n/an/a 3.10E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116895
PNG
(CHEMBL3613033)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCCCCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C26H35N3O7/c1-20(31)35-24-13-11-22(18-25(24)36-21(2)32)12-14-26(33)34-17-8-6-4-3-5-7-10-23-19-27-28-29(23)15-9-16-30/h11-14,18-19,30H,3-10,15-17H2,1-2H3/b14-12+
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n/an/a 3.20E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116897
PNG
(CHEMBL3613031)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C22H27N3O7/c1-16(27)31-20-9-7-18(14-21(20)32-17(2)28)8-10-22(29)30-13-4-3-6-19-15-23-24-25(19)11-5-12-26/h7-10,14-15,26H,3-6,11-13H2,1-2H3/b10-8+
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n/an/a 6.10E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116896
PNG
(CHEMBL3613032)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C23H29N3O7/c1-17(28)32-21-10-8-19(15-22(21)33-18(2)29)9-11-23(30)31-14-5-3-4-7-20-16-24-25-26(20)12-6-13-27/h8-11,15-16,27H,3-7,12-14H2,1-2H3/b11-9+
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n/an/a 6.70E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116898
PNG
(CHEMBL3613030)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C20H23N3O7/c1-14(25)29-18-6-4-16(12-19(18)30-15(2)26)5-7-20(27)28-11-8-17-13-21-22-23(17)9-3-10-24/h4-7,12-13,24H,3,8-11H2,1-2H3/b7-5+
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n/an/a 7.40E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116892
PNG
(CHEMBL3613036)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCn2cc(CCO)nn2)cc1OC(C)=O
Show InChI InChI=1S/C20H23N3O7/c1-14(25)29-18-6-4-16(12-19(18)30-15(2)26)5-7-20(27)28-11-3-9-23-13-17(8-10-24)21-22-23/h4-7,12-13,24H,3,8-11H2,1-2H3/b7-5+
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n/an/a 7.60E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116897
PNG
(CHEMBL3613031)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C22H27N3O7/c1-16(27)31-20-9-7-18(14-21(20)32-17(2)28)8-10-22(29)30-13-4-3-6-19-15-23-24-25(19)11-5-12-26/h7-10,14-15,26H,3-6,11-13H2,1-2H3/b10-8+
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n/an/a 7.60E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116901
PNG
(CHEMBL3613027)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)NCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C17H17NO5/c1-4-5-10-18-17(21)9-7-14-6-8-15(22-12(2)19)16(11-14)23-13(3)20/h1,6-9,11H,5,10H2,2-3H3,(H,18,21)/b9-7+
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n/an/a 8.23E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM4375
PNG
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)
Show SMILES OC(=O)\C=C\c1ccc(O)c(O)c1
Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+
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n/an/a 8.50E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116898
PNG
(CHEMBL3613030)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C20H23N3O7/c1-14(25)29-18-6-4-16(12-19(18)30-15(2)26)5-7-20(27)28-11-8-17-13-21-22-23(17)9-3-10-24/h4-7,12-13,24H,3,8-11H2,1-2H3/b7-5+
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n/an/a 9.90E+3n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116902
PNG
(CHEMBL3613026)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCCCCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C23H28O6/c1-4-5-6-7-8-9-10-11-16-27-23(26)15-13-20-12-14-21(28-18(2)24)22(17-20)29-19(3)25/h1,12-15,17H,5-11,16H2,2-3H3/b15-13+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116906
PNG
(CHEMBL3613022)
Show SMILES CC(=O)Oc1ccc(\C=C\C(O)=O)cc1OC(C)=O
Show InChI InChI=1S/C13H12O6/c1-8(14)18-11-5-3-10(4-6-13(16)17)7-12(11)19-9(2)15/h3-7H,1-2H3,(H,16,17)/b6-4+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116892
PNG
(CHEMBL3613036)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCn2cc(CCO)nn2)cc1OC(C)=O
Show InChI InChI=1S/C20H23N3O7/c1-14(25)29-18-6-4-16(12-19(18)30-15(2)26)5-7-20(27)28-11-3-9-23-13-17(8-10-24)21-22-23/h4-7,12-13,24H,3,8-11H2,1-2H3/b7-5+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116889
PNG
(CHEMBL3613039)
Show SMILES CC(=O)Oc1c(C)c(C)c2OC(C)(CCc2c1C)C(=O)OCCCN=[N+]=[N-]
Show InChI InChI=1S/C19H25N3O5/c1-11-12(2)17-15(13(3)16(11)26-14(4)23)7-8-19(5,27-17)18(24)25-10-6-9-21-22-20/h6-10H2,1-5H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116891
PNG
(CHEMBL3613037)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCn2cc(CCOC(=O)\C=C\c3ccc(OC(C)=O)c(OC(C)=O)c3)nn2)cc1OC(C)=O
Show InChI InChI=1S/C33H33N3O12/c1-21(37)45-28-10-6-25(18-30(28)47-23(3)39)8-12-32(41)43-16-5-15-36-20-27(34-35-36)14-17-44-33(42)13-9-26-7-11-29(46-22(2)38)31(19-26)48-24(4)40/h6-13,18-20H,5,14-17H2,1-4H3/b12-8+,13-9+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116894
PNG
(CHEMBL3613034)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)NCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C20H24N4O6/c1-14(26)29-18-6-4-16(12-19(18)30-15(2)27)5-7-20(28)21-9-8-17-13-22-23-24(17)10-3-11-25/h4-7,12-13,25H,3,8-11H2,1-2H3,(H,21,28)/b7-5+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116890
PNG
(CHEMBL3613038)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCc2cnnn2CCCOC(=O)C2(C)CCc3c(C)c(OC(C)=O)c(C)c(C)c3O2)cc1OC(C)=O
Show InChI InChI=1S/C36H41N3O11/c1-21-22(2)34-29(23(3)33(21)49-26(6)42)13-15-36(7,50-34)35(44)46-17-8-16-39-28(20-37-38-39)14-18-45-32(43)12-10-27-9-11-30(47-24(4)40)31(19-27)48-25(5)41/h9-12,19-20H,8,13-18H2,1-7H3/b12-10+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116900
PNG
(CHEMBL3613028)
Show SMILES Fc1ccc(\C=C\C(=O)OCCC#C)cc1F
Show InChI InChI=1S/C13H10F2O2/c1-2-3-8-17-13(16)7-5-10-4-6-11(14)12(15)9-10/h1,4-7,9H,3,8H2/b7-5+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116903
PNG
(CHEMBL3613025)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C20H22O6/c1-4-5-6-7-8-13-24-20(23)12-10-17-9-11-18(25-15(2)21)19(14-17)26-16(3)22/h1,9-12,14H,5-8,13H2,2-3H3/b12-10+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116906
PNG
(CHEMBL3613022)
Show SMILES CC(=O)Oc1ccc(\C=C\C(O)=O)cc1OC(C)=O
Show InChI InChI=1S/C13H12O6/c1-8(14)18-11-5-3-10(4-6-13(16)17)7-12(11)19-9(2)15/h3-7H,1-2H3,(H,16,17)/b6-4+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116904
PNG
(CHEMBL3613024)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C19H20O6/c1-4-5-6-7-12-23-19(22)11-9-16-8-10-17(24-14(2)20)18(13-16)25-15(3)21/h1,8-11,13H,5-7,12H2,2-3H3/b11-9+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116900
PNG
(CHEMBL3613028)
Show SMILES Fc1ccc(\C=C\C(=O)OCCC#C)cc1F
Show InChI InChI=1S/C13H10F2O2/c1-2-3-8-17-13(16)7-5-10-4-6-11(14)12(15)9-10/h1,4-7,9H,3,8H2/b7-5+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM4375
PNG
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)
Show SMILES OC(=O)\C=C\c1ccc(O)c(O)c1
Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116893
PNG
(CHEMBL3613035)
Show SMILES OCCCn1nncc1CCOC(=O)\C=C\c1ccc(F)c(F)c1
Show InChI InChI=1S/C16H17F2N3O3/c17-14-4-2-12(10-15(14)18)3-5-16(23)24-9-6-13-11-19-20-21(13)7-1-8-22/h2-5,10-11,22H,1,6-9H2/b5-3+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116893
PNG
(CHEMBL3613035)
Show SMILES OCCCn1nncc1CCOC(=O)\C=C\c1ccc(F)c(F)c1
Show InChI InChI=1S/C16H17F2N3O3/c17-14-4-2-12(10-15(14)18)3-5-16(23)24-9-6-13-11-19-20-21(13)7-1-8-22/h2-5,10-11,22H,1,6-9H2/b5-3+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli Bl21 (DE3) assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 10 mins b...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116899
PNG
(CHEMBL3613029)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)CCCN=[N+]=[N-])cc1OC(C)=O
Show InChI InChI=1S/C16H17N3O5/c1-11(20)23-15-8-6-13(10-16(15)24-12(2)21)5-7-14(22)4-3-9-18-19-17/h5-8,10H,3-4,9H2,1-2H3/b7-5+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116894
PNG
(CHEMBL3613034)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)NCCc2cnnn2CCCO)cc1OC(C)=O
Show InChI InChI=1S/C20H24N4O6/c1-14(26)29-18-6-4-16(12-19(18)30-15(2)27)5-7-20(28)21-9-8-17-13-22-23-24(17)10-3-11-25/h4-7,12-13,25H,3,8-11H2,1-2H3,(H,21,28)/b7-5+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116905
PNG
(CHEMBL3613023)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)OCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C17H16O6/c1-4-5-10-21-17(20)9-7-14-6-8-15(22-12(2)18)16(11-14)23-13(3)19/h1,6-9,11H,5,10H2,2-3H3/b9-7+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))
BDBM50116901
PNG
(CHEMBL3613027)
Show SMILES CC(=O)Oc1ccc(\C=C\C(=O)NCCC#C)cc1OC(C)=O
Show InChI InChI=1S/C17H17NO5/c1-4-5-10-18-17(21)9-7-14-6-8-15(22-12(2)19)16(11-14)23-13(3)20/h1,6-9,11H,5,10H2,2-3H3,(H,18,21)/b9-7+
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n/an/a>1.00E+4n/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human neutrophils assessed as reduction in LTB4 and 5-H(P)ETE) formation pre-incubated for 15 mins before A23187 and arachidon...


Eur J Med Chem 101: 573-83 (2015)


Article DOI: 10.1016/j.ejmech.2015.07.011
BindingDB Entry DOI: 10.7270/Q2V69MDP
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%