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PubMed code 22326163

Compile data set for download or QSAR
Found 63 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))		BDBM50365616
PNG
(CHEMBL1958141)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C27H29N3O/c1-20-12-17-25-29-26(27(30(25)18-20)28-23-10-6-3-7-11-23)22-13-15-24(16-14-22)31-19-21-8-4-2-5-9-21/h2,4-5,8-9,12-18,23,28H,3,6-7,10-11,19H2,1H3
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n/an/a 30n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365618
PNG
(CHEMBL1958143)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C27H29N3O/c1-20-15-16-25-29-26(27(30(25)18-20)28-23-12-6-3-7-13-23)22-11-8-14-24(17-22)31-19-21-9-4-2-5-10-21/h2,4-5,8-11,14-18,23,28H,3,6-7,12-13,19H2,1H3
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n/an/a 40n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365646
PNG
(CHEMBL1958140)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C26H27N3O/c1-19-15-16-24-28-25(26(29(24)18-19)27-21-10-4-2-5-11-21)20-9-8-14-23(17-20)30-22-12-6-3-7-13-22/h3,6-9,12-18,21,27H,2,4-5,10-11H2,1H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM22334
PNG
(BW A4C | BW4C | BWA4C | BWA4C, 10 | CHEMBL314360 |...)
Show SMILES CC(=O)N(O)C\C=C\c1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C17H17NO3/c1-14(19)18(20)12-6-8-15-7-5-11-17(13-15)21-16-9-3-2-4-10-16/h2-11,13,20H,12H2,1H3/b8-6+
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n/an/a 50n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365637
PNG
(CHEMBL1957976)
Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc2ccc(Cl)cn2c1NC1CCCCC1
Show InChI InChI=1S/C28H36ClN5O2/c1-28(2,3)36-27(35)33-17-15-32(16-18-33)23-12-9-20(10-13-23)25-26(30-22-7-5-4-6-8-22)34-19-21(29)11-14-24(34)31-25/h9-14,19,22,30H,4-8,15-18H2,1-3H3
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n/an/a 60n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365636
PNG
(CHEMBL1957975)
Show SMILES Clc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H29ClN4/c25-19-11-14-22-27-23(24(29(22)17-19)26-20-7-3-1-4-8-20)18-9-12-21(13-10-18)28-15-5-2-6-16-28/h9-14,17,20,26H,1-8,15-16H2
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n/an/a 60n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM22334
PNG
(BW A4C | BW4C | BWA4C | BWA4C, 10 | CHEMBL314360 |...)
Show SMILES CC(=O)N(O)C\C=C\c1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C17H17NO3/c1-14(19)18(20)12-6-8-15-7-5-11-17(13-15)21-16-9-3-2-4-10-16/h2-11,13,20H,12H2,1H3/b8-6+
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365631
PNG
(CHEMBL1957970)
Show SMILES CN(C)c1ccc(cc1)-c1nc2ccc(Cl)cn2c1NC1CCCCC1
Show InChI InChI=1S/C21H25ClN4/c1-25(2)18-11-8-15(9-12-18)20-21(23-17-6-4-3-5-7-17)26-14-16(22)10-13-19(26)24-20/h8-14,17,23H,3-7H2,1-2H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365617
PNG
(CHEMBL1958142)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C26H27N3O/c1-19-12-17-24-28-25(26(29(24)18-19)27-21-8-4-2-5-9-21)20-13-15-23(16-14-20)30-22-10-6-3-7-11-22/h3,6-7,10-18,21,27H,2,4-5,8-9H2,1H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365632
PNG
(CHEMBL1957971)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C24H30N4O/c1-18-7-12-22-26-23(24(28(22)17-18)25-20-5-3-2-4-6-20)19-8-10-21(11-9-19)27-13-15-29-16-14-27/h7-12,17,20,25H,2-6,13-16H2,1H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365631
PNG
(CHEMBL1957970)
Show SMILES CN(C)c1ccc(cc1)-c1nc2ccc(Cl)cn2c1NC1CCCCC1
Show InChI InChI=1S/C21H25ClN4/c1-25(2)18-11-8-15(9-12-18)20-21(23-17-6-4-3-5-7-17)26-14-16(22)10-13-19(26)24-20/h8-14,17,23H,3-7H2,1-2H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365636
PNG
(CHEMBL1957975)
Show SMILES Clc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)N1CCCCC1
Show InChI InChI=1S/C24H29ClN4/c25-19-11-14-22-27-23(24(29(22)17-19)26-20-7-3-1-4-8-20)18-9-12-21(13-10-18)28-15-5-2-6-16-28/h9-14,17,20,26H,1-8,15-16H2
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365634
PNG
(CHEMBL1957973)
Show SMILES Brc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C23H27BrN4O/c24-18-8-11-21-26-22(23(28(21)16-18)25-19-4-2-1-3-5-19)17-6-9-20(10-7-17)27-12-14-29-15-13-27/h6-11,16,19,25H,1-5,12-15H2
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365632
PNG
(CHEMBL1957971)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C24H30N4O/c1-18-7-12-22-26-23(24(28(22)17-18)25-20-5-3-2-4-6-20)19-8-10-21(11-9-19)27-13-15-29-16-14-27/h7-12,17,20,25H,2-6,13-16H2,1H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365633
PNG
(CHEMBL1957972)
Show SMILES Clc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C23H27ClN4O/c24-18-8-11-21-26-22(23(28(21)16-18)25-19-4-2-1-3-5-19)17-6-9-20(10-7-17)27-12-14-29-15-13-27/h6-11,16,19,25H,1-5,12-15H2
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365617
PNG
(CHEMBL1958142)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C26H27N3O/c1-19-12-17-24-28-25(26(29(24)18-19)27-21-8-4-2-5-9-21)20-13-15-23(16-14-20)30-22-10-6-3-7-11-22/h3,6-7,10-18,21,27H,2,4-5,8-9H2,1H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365633
PNG
(CHEMBL1957972)
Show SMILES Clc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C23H27ClN4O/c24-18-8-11-21-26-22(23(28(21)16-18)25-19-4-2-1-3-5-19)17-6-9-20(10-7-17)27-12-14-29-15-13-27/h6-11,16,19,25H,1-5,12-15H2
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365616
PNG
(CHEMBL1958141)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C27H29N3O/c1-20-12-17-25-29-26(27(30(25)18-20)28-23-10-6-3-7-11-23)22-13-15-24(16-14-22)31-19-21-8-4-2-5-9-21/h2,4-5,8-9,12-18,23,28H,3,6-7,10-11,19H2,1H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365629
PNG
(CHEMBL1957968)
Show SMILES O=C(Nc1ccc(cc1)-c1nc2ccccn2c1NC1CCCCC1)c1cccs1
Show InChI InChI=1S/C24H24N4OS/c29-24(20-9-6-16-30-20)26-19-13-11-17(12-14-19)22-23(25-18-7-2-1-3-8-18)28-15-5-4-10-21(28)27-22/h4-6,9-16,18,25H,1-3,7-8H2,(H,26,29)
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365629
PNG
(CHEMBL1957968)
Show SMILES O=C(Nc1ccc(cc1)-c1nc2ccccn2c1NC1CCCCC1)c1cccs1
Show InChI InChI=1S/C24H24N4OS/c29-24(20-9-6-16-30-20)26-19-13-11-17(12-14-19)22-23(25-18-7-2-1-3-8-18)28-15-5-4-10-21(28)27-22/h4-6,9-16,18,25H,1-3,7-8H2,(H,26,29)
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365635
PNG
(CHEMBL1957974)
Show SMILES C1CCC(CC1)Nc1c(nc2ccccn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C23H28N4O/c1-2-6-19(7-3-1)24-23-22(25-21-8-4-5-13-27(21)23)18-9-11-20(12-10-18)26-14-16-28-17-15-26/h4-5,8-13,19,24H,1-3,6-7,14-17H2
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365618
PNG
(CHEMBL1958143)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1cccc(OCc2ccccc2)c1
Show InChI InChI=1S/C27H29N3O/c1-20-15-16-25-29-26(27(30(25)18-20)28-23-12-6-3-7-13-23)22-11-8-14-24(17-22)31-19-21-9-4-2-5-10-21/h2,4-5,8-11,14-18,23,28H,3,6-7,12-13,19H2,1H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365644
PNG
(CHEMBL1958138)
Show SMILES COc1cccc(c1)-c1nc2ccc(C)cn2c1NC1CCCCC1
Show InChI InChI=1S/C21H25N3O/c1-15-11-12-19-23-20(16-7-6-10-18(13-16)25-2)21(24(19)14-15)22-17-8-4-3-5-9-17/h6-7,10-14,17,22H,3-5,8-9H2,1-2H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365637
PNG
(CHEMBL1957976)
Show SMILES CC(C)(C)OC(=O)N1CCN(CC1)c1ccc(cc1)-c1nc2ccc(Cl)cn2c1NC1CCCCC1
Show InChI InChI=1S/C28H36ClN5O2/c1-28(2,3)36-27(35)33-17-15-32(16-18-33)23-12-9-20(10-13-23)25-26(30-22-7-5-4-6-8-22)34-19-21(29)11-14-24(34)31-25/h9-14,19,22,30H,4-8,15-18H2,1-3H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365646
PNG
(CHEMBL1958140)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C26H27N3O/c1-19-15-16-24-28-25(26(29(24)18-19)27-21-10-4-2-5-11-21)20-9-8-14-23(17-20)30-22-12-6-3-7-13-22/h3,6-9,12-18,21,27H,2,4-5,10-11H2,1H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
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 500n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365628
PNG
(CHEMBL1957967)
Show SMILES COc1ccc(cc1)-c1nc2ccc(C)cn2c1NC1CCCCC1
Show InChI InChI=1S/C21H25N3O/c1-15-8-13-19-23-20(16-9-11-18(25-2)12-10-16)21(24(19)14-15)22-17-6-4-3-5-7-17/h8-14,17,22H,3-7H2,1-2H3
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n/an/a 500n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365643
PNG
(CHEMBL1957982)
Show SMILES CN(C)c1ccc(cc1)-c1nc2ccc(Cl)cc2n1CC1CCCCC1
Show InChI InChI=1S/C22H26ClN3/c1-25(2)19-11-8-17(9-12-19)22-24-20-13-10-18(23)14-21(20)26(22)15-16-6-4-3-5-7-16/h8-14,16H,3-7,15H2,1-2H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365635
PNG
(CHEMBL1957974)
Show SMILES C1CCC(CC1)Nc1c(nc2ccccn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C23H28N4O/c1-2-6-19(7-3-1)24-23-22(25-21-8-4-5-13-27(21)23)18-9-11-20(12-10-18)26-14-16-28-17-15-26/h4-5,8-13,19,24H,1-3,6-7,14-17H2
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365626
PNG
(CHEMBL1957965)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C20H23N3O/c1-14-7-12-18-22-19(15-8-10-17(24)11-9-15)20(23(18)13-14)21-16-5-3-2-4-6-16/h7-13,16,21,24H,2-6H2,1H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365620
PNG
(CHEMBL1957963)
Show SMILES CN(C)c1ccc(cc1)-c1nc2ccc(C)cn2c1NC1CCCCC1
Show InChI InChI=1S/C22H28N4/c1-16-9-14-20-24-21(17-10-12-19(13-11-17)25(2)3)22(26(20)15-16)23-18-7-5-4-6-8-18/h9-15,18,23H,4-8H2,1-3H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365641
PNG
(CHEMBL1957980)
Show SMILES C1CCC(CC1)Nc1c(nc2sccn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C21H26N4OS/c1-2-4-17(5-3-1)22-20-19(23-21-25(20)12-15-27-21)16-6-8-18(9-7-16)24-10-13-26-14-11-24/h6-9,12,15,17,22H,1-5,10-11,13-14H2
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365645
PNG
(CHEMBL1958139)
Show SMILES COc1ccc(cc1OC)-c1nc2ccc(C)cn2c1NC1CCCCC1
Show InChI InChI=1S/C22H27N3O2/c1-15-9-12-20-24-21(16-10-11-18(26-2)19(13-16)27-3)22(25(20)14-15)23-17-7-5-4-6-8-17/h9-14,17,23H,4-8H2,1-3H3
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ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365634
PNG
(CHEMBL1957973)
Show SMILES Brc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C23H27BrN4O/c24-18-8-11-21-26-22(23(28(21)16-18)25-19-4-2-1-3-5-19)17-6-9-20(10-7-17)27-12-14-29-15-13-27/h6-11,16,19,25H,1-5,12-15H2
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n/an/a 770n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365619
PNG
(CHEMBL1955887)
Show SMILES Cc1ccc(cc1)-c1nc2cc(C)ccn2c1NC1CCCC1
Show InChI InChI=1S/C20H23N3/c1-14-7-9-16(10-8-14)19-20(21-17-5-3-4-6-17)23-12-11-15(2)13-18(23)22-19/h7-13,17,21H,3-6H2,1-2H3
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n/an/a 900n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365627
PNG
(CHEMBL1957966)
Show SMILES Oc1ccc(cc1)-c1nc2ccc(Br)cn2c1NC1CCCCC1
Show InChI InChI=1S/C19H20BrN3O/c20-14-8-11-17-22-18(13-6-9-16(24)10-7-13)19(23(17)12-14)21-15-4-2-1-3-5-15/h6-12,15,21,24H,1-5H2
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n/an/a 900n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365627
PNG
(CHEMBL1957966)
Show SMILES Oc1ccc(cc1)-c1nc2ccc(Br)cn2c1NC1CCCCC1
Show InChI InChI=1S/C19H20BrN3O/c20-14-8-11-17-22-18(13-6-9-16(24)10-7-13)19(23(17)12-14)21-15-4-2-1-3-5-15/h6-12,15,21,24H,1-5H2
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n/an/a 1.10E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365622
PNG
(CHEMBL1957961)
Show SMILES Cc1cccn2c(NC3CCCCC3)c(nc12)-c1ccc(F)cc1
Show InChI InChI=1S/C20H22FN3/c1-14-6-5-13-24-19(14)23-18(15-9-11-16(21)12-10-15)20(24)22-17-7-3-2-4-8-17/h5-6,9-13,17,22H,2-4,7-8H2,1H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365642
PNG
(CHEMBL1957981)
Show SMILES Clc1ccc2nc(-c3ccc(cc3)N3CCOCC3)n(CC3CCCCC3)c2c1
Show InChI InChI=1S/C24H28ClN3O/c25-20-8-11-22-23(16-20)28(17-18-4-2-1-3-5-18)24(26-22)19-6-9-21(10-7-19)27-12-14-29-15-13-27/h6-11,16,18H,1-5,12-15,17H2
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n/an/a 1.20E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365644
PNG
(CHEMBL1958138)
Show SMILES COc1cccc(c1)-c1nc2ccc(C)cn2c1NC1CCCCC1
Show InChI InChI=1S/C21H25N3O/c1-15-11-12-19-23-20(16-7-6-10-18(13-16)25-2)21(24(19)14-15)22-17-8-4-3-5-9-17/h6-7,10-14,17,22H,3-5,8-9H2,1-2H3
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n/an/a 1.22E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365645
PNG
(CHEMBL1958139)
Show SMILES COc1ccc(cc1OC)-c1nc2ccc(C)cn2c1NC1CCCCC1
Show InChI InChI=1S/C22H27N3O2/c1-15-9-12-20-24-21(16-10-11-18(26-2)19(13-16)27-3)22(25(20)14-15)23-17-7-5-4-6-8-17/h9-14,17,23H,4-8H2,1-3H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365628
PNG
(CHEMBL1957967)
Show SMILES COc1ccc(cc1)-c1nc2ccc(C)cn2c1NC1CCCCC1
Show InChI InChI=1S/C21H25N3O/c1-15-8-13-19-23-20(16-9-11-18(25-2)12-10-16)21(24(19)14-15)22-17-6-4-3-5-7-17/h8-14,17,22H,3-7H2,1-2H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365641
PNG
(CHEMBL1957980)
Show SMILES C1CCC(CC1)Nc1c(nc2sccn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C21H26N4OS/c1-2-4-17(5-3-1)22-20-19(23-21-25(20)12-15-27-21)16-6-8-18(9-7-16)24-10-13-26-14-11-24/h6-9,12,15,17,22H,1-5,10-11,13-14H2
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n/an/a 1.50E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365623
PNG
(CHEMBL1957962)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C20H22N4O2/c1-14-7-12-18-22-19(15-8-10-17(11-9-15)24(25)26)20(23(18)13-14)21-16-5-3-2-4-6-16/h7-13,16,21H,2-6H2,1H3
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n/an/a 1.53E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365639
PNG
(CHEMBL1957978)
Show SMILES C1CCC(CC1)Nc1c(nc2cccnn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C22H27N5O/c1-2-5-18(6-3-1)24-22-21(25-20-7-4-12-23-27(20)22)17-8-10-19(11-9-17)26-13-15-28-16-14-26/h4,7-12,18,24H,1-3,5-6,13-16H2
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n/an/a 1.76E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365630
PNG
(CHEMBL1957969)
Show SMILES CCOc1ccc2[nH]c(=O)c(cc2c1)-c1nc2ccc(C)cn2c1NC1CCCCC1
Show InChI InChI=1S/C25H28N4O2/c1-3-31-19-10-11-21-17(13-19)14-20(25(30)27-21)23-24(26-18-7-5-4-6-8-18)29-15-16(2)9-12-22(29)28-23/h9-15,18,26H,3-8H2,1-2H3,(H,27,30)
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n/an/a 1.80E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365625
PNG
(CHEMBL1957964)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccccc1O
Show InChI InChI=1S/C20H23N3O/c1-14-11-12-18-22-19(16-9-5-6-10-17(16)24)20(23(18)13-14)21-15-7-3-2-4-8-15/h5-6,9-13,15,21,24H,2-4,7-8H2,1H3
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n/an/a 1.80E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365640
PNG
(CHEMBL1957979)
Show SMILES C1CCC(CC1)Nc1c(nc2cnccn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C22H27N5O/c1-2-4-18(5-3-1)24-22-21(25-20-16-23-10-11-27(20)22)17-6-8-19(9-7-17)26-12-14-28-15-13-26/h6-11,16,18,24H,1-5,12-15H2
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n/an/a 1.80E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365625
PNG
(CHEMBL1957964)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccccc1O
Show InChI InChI=1S/C20H23N3O/c1-14-11-12-18-22-19(16-9-5-6-10-17(16)24)20(23(18)13-14)21-15-7-3-2-4-8-15/h5-6,9-13,15,21,24H,2-4,7-8H2,1H3
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n/an/a 1.90E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365626
PNG
(CHEMBL1957965)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(O)cc1
Show InChI InChI=1S/C20H23N3O/c1-14-7-12-18-22-19(15-8-10-17(24)11-9-15)20(23(18)13-14)21-16-5-3-2-4-6-16/h7-13,16,21,24H,2-6H2,1H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365622
PNG
(CHEMBL1957961)
Show SMILES Cc1cccn2c(NC3CCCCC3)c(nc12)-c1ccc(F)cc1
Show InChI InChI=1S/C20H22FN3/c1-14-6-5-13-24-19(14)23-18(15-9-11-16(21)12-10-15)20(24)22-17-7-3-2-4-8-17/h5-6,9-13,17,22H,2-4,7-8H2,1H3
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n/an/a 2.10E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365639
PNG
(CHEMBL1957978)
Show SMILES C1CCC(CC1)Nc1c(nc2cccnn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C22H27N5O/c1-2-5-18(6-3-1)24-22-21(25-20-7-4-12-23-27(20)22)17-8-10-19(11-9-17)26-13-15-28-16-14-26/h4,7-12,18,24H,1-3,5-6,13-16H2
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n/an/a 2.22E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365621
PNG
(CHEMBL1914961)
Show SMILES Clc1ccc(cc1)-c1nc2cnccn2c1NC1CCCCC1
Show InChI InChI=1S/C18H19ClN4/c19-14-8-6-13(7-9-14)17-18(21-15-4-2-1-3-5-15)23-11-10-20-12-16(23)22-17/h6-12,15,21H,1-5H2
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n/an/a 2.30E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365640
PNG
(CHEMBL1957979)
Show SMILES C1CCC(CC1)Nc1c(nc2cnccn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C22H27N5O/c1-2-4-18(5-3-1)24-22-21(25-20-16-23-10-11-27(20)22)17-6-8-19(9-7-17)26-12-14-28-15-13-26/h6-11,16,18,24H,1-5,12-15H2
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n/an/a 2.62E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365638
PNG
(CHEMBL1957977)
Show SMILES C1CCC(CC1)Nc1c(nc2ncccn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C22H27N5O/c1-2-5-18(6-3-1)24-21-20(25-22-23-11-4-12-27(21)22)17-7-9-19(10-8-17)26-13-15-28-16-14-26/h4,7-12,18,24H,1-3,5-6,13-16H2
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n/an/a 3.55E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365642
PNG
(CHEMBL1957981)
Show SMILES Clc1ccc2nc(-c3ccc(cc3)N3CCOCC3)n(CC3CCCCC3)c2c1
Show InChI InChI=1S/C24H28ClN3O/c25-20-8-11-22-23(16-20)28(17-18-4-2-1-3-5-18)24(26-22)19-6-9-21(10-7-19)27-12-14-29-15-13-27/h6-11,16,18H,1-5,12-15,17H2
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n/an/a 5.80E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365638
PNG
(CHEMBL1957977)
Show SMILES C1CCC(CC1)Nc1c(nc2ncccn12)-c1ccc(cc1)N1CCOCC1
Show InChI InChI=1S/C22H27N5O/c1-2-5-18(6-3-1)24-21-20(25-22-23-11-4-12-27(21)22)17-7-9-19(10-8-17)26-13-15-28-16-14-26/h4,7-12,18,24H,1-3,5-6,13-16H2
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n/an/a 6.10E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365624
PNG
(CHEMBL1430378)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccncc1
Show InChI InChI=1S/C19H22N4/c1-14-7-8-17-22-18(15-9-11-20-12-10-15)19(23(17)13-14)21-16-5-3-2-4-6-16/h7-13,16,21H,2-6H2,1H3
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n/an/a 7.20E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as reduction in A23187 and AA-stimulated 5-LO product formation preincuba...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365624
PNG
(CHEMBL1430378)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccncc1
Show InChI InChI=1S/C19H22N4/c1-14-7-8-17-22-18(15-9-11-20-12-10-15)19(23(17)13-14)21-16-5-3-2-4-6-16/h7-13,16,21H,2-6H2,1H3
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n/an/a 7.70E+3n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365643
PNG
(CHEMBL1957982)
Show SMILES CN(C)c1ccc(cc1)-c1nc2ccc(Cl)cc2n1CC1CCCCC1
Show InChI InChI=1S/C22H26ClN3/c1-25(2)19-11-8-17(9-12-19)22-24-20-13-10-18(23)14-21(20)26(22)15-16-6-4-3-5-7-16/h8-14,16H,3-7,15H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365621
PNG
(CHEMBL1914961)
Show SMILES Clc1ccc(cc1)-c1nc2cnccn2c1NC1CCCCC1
Show InChI InChI=1S/C18H19ClN4/c19-14-8-6-13(7-9-14)17-18(21-15-4-2-1-3-5-15)23-11-10-20-12-16(23)22-17/h6-12,15,21H,1-5H2
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n/an/a 2.15E+4n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365630
PNG
(CHEMBL1957969)
Show SMILES CCOc1ccc2[nH]c(=O)c(cc2c1)-c1nc2ccc(C)cn2c1NC1CCCCC1
Show InChI InChI=1S/C25H28N4O2/c1-3-31-19-10-11-21-17(13-19)14-20(25(30)27-21)23-24(26-18-7-5-4-6-8-18)29-15-16(2)9-12-22(29)28-23/h9-15,18,26H,3-8H2,1-2H3,(H,27,30)
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n/an/a 2.16E+4n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
Polyunsaturated fatty acid 5-lipoxygenase


(Homo sapiens (Human))		BDBM50365623
PNG
(CHEMBL1957962)
Show SMILES Cc1ccc2nc(c(NC3CCCCC3)n2c1)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C20H22N4O2/c1-14-7-12-18-22-19(15-8-10-17(11-9-15)24(25)26)20(23(18)13-14)21-16-5-3-2-4-6-16/h7-13,16,21H,2-6H2,1H3
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n/an/a>3.00E+4n/an/an/an/an/an/a



ZAFES/LiFF/OSF Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 cell free fraction of human polymorphonuclear leukocytes assessed as reduction in 5-LO product formation preincu...

Bioorg Med Chem Lett 22: 1969-75 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.038
BindingDB Entry DOI: 10.7270/Q2P84CCK
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%