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PubMed code 1648621

Compile data set for download or QSAR
Found 50 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
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50000832
PNG
(2-{1-Methoxy-1-[3-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES COC(C)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H21NO2S/c1-23(25-2,22-24-12-13-27-22)20-8-5-9-21(15-20)26-16-17-10-11-18-6-3-4-7-19(18)14-17/h3-15H,16H2,1-2H3
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n/an/a 5n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50007052
PNG
(1-[3-(3-Phenyl-allyloxy)-phenyl]-1-thiazol-2-yl-pr...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OC\C=C\c2ccccc2)c1
Show InChI InChI=1S/C21H21NO2S/c1-2-21(23,20-22-13-15-25-20)18-11-6-12-19(16-18)24-14-7-10-17-8-4-3-5-9-17/h3-13,15-16,23H,2,14H2,1H3/b10-7+
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


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

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


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

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50007057
PNG
(1-[3-(3-Phenyl-prop-2-ynyloxy)-phenyl]-1-thiazol-2...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OCC#Cc2ccccc2)c1
Show InChI InChI=1S/C21H19NO2S/c1-2-21(23,20-22-13-15-25-20)18-11-6-12-19(16-18)24-14-7-10-17-8-4-3-5-9-17/h3-6,8-9,11-13,15-16,23H,2,14H2,1H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50000832
PNG
(2-{1-Methoxy-1-[3-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES COC(C)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H21NO2S/c1-23(25-2,22-24-12-13-27-22)20-8-5-9-21(15-20)26-16-17-10-11-18-6-3-4-7-19(18)14-17/h3-15H,16H2,1-2H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50007051
PNG
(1-[3-(Naphthalen-2-ylmethoxy)-phenyl]-1-thiazol-2-...)
Show SMILES CCCC(O)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H23NO2S/c1-2-12-24(26,23-25-13-14-28-23)21-8-5-9-22(16-21)27-17-18-10-11-19-6-3-4-7-20(19)15-18/h3-11,13-16,26H,2,12,17H2,1H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


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

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in guinea pig.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50007042
PNG
(2-{Methoxy-[3-(naphthalen-2-ylmethoxy)-phenyl]-met...)
Show SMILES COC(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H19NO2S/c1-24-21(22-23-11-12-26-22)19-7-4-8-20(14-19)25-15-16-9-10-17-5-2-3-6-18(17)13-16/h2-14,21H,15H2,1H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


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

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


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

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in rat whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50000832
PNG
(2-{1-Methoxy-1-[3-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES COC(C)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H21NO2S/c1-23(25-2,22-24-12-13-27-22)20-8-5-9-21(15-20)26-16-17-10-11-18-6-3-4-7-19(18)14-17/h3-15H,16H2,1-2H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in guinea pig.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50000832
PNG
(2-{1-Methoxy-1-[3-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES COC(C)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H21NO2S/c1-23(25-2,22-24-12-13-27-22)20-8-5-9-21(15-20)26-16-17-10-11-18-6-3-4-7-19(18)14-17/h3-15H,16H2,1-2H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in guinea pig.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


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

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007056
PNG
(1-Thiazol-2-yl-1-[3-(3-o-tolyl-prop-2-ynyloxy)-phe...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OCC#Cc2ccccc2C)c1
Show InChI InChI=1S/C22H21NO2S/c1-3-22(24,21-23-13-15-26-21)19-11-6-12-20(16-19)25-14-7-10-18-9-5-4-8-17(18)2/h4-6,8-9,11-13,15-16,24H,3,14H2,1-2H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


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

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50000832
PNG
(2-{1-Methoxy-1-[3-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES COC(C)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H21NO2S/c1-23(25-2,22-24-12-13-27-22)20-8-5-9-21(15-20)26-16-17-10-11-18-6-3-4-7-19(18)14-17/h3-15H,16H2,1-2H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Rattus norvegicus)
BDBM50000832
PNG
(2-{1-Methoxy-1-[3-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES COC(C)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C23H21NO2S/c1-23(25-2,22-24-12-13-27-22)20-8-5-9-21(15-20)26-16-17-10-11-18-6-3-4-7-19(18)14-17/h3-15H,16H2,1-2H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in rat whole blood.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50007047
PNG
(1-[3-(3,4-Difluoro-benzyloxy)-phenyl]-1-thiazol-2-...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OCc2ccc(F)c(F)c2)c1
Show InChI InChI=1S/C19H17F2NO2S/c1-2-19(23,18-22-8-9-25-18)14-4-3-5-15(11-14)24-12-13-6-7-16(20)17(21)10-13/h3-11,23H,2,12H2,1H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007052
PNG
(1-[3-(3-Phenyl-allyloxy)-phenyl]-1-thiazol-2-yl-pr...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OC\C=C\c2ccccc2)c1
Show InChI InChI=1S/C21H21NO2S/c1-2-21(23,20-22-13-15-25-20)18-11-6-12-19(16-18)24-14-7-10-17-8-4-3-5-9-17/h3-13,15-16,23H,2,14H2,1H3/b10-7+
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50007060
PNG
(1-(4-Methyl-thiazol-2-yl)-1-[3-(naphthalen-2-ylmet...)
Show SMILES CCC(O)(c1nc(C)cs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H23NO2S/c1-3-24(26,23-25-17(2)16-28-23)21-9-6-10-22(14-21)27-15-18-11-12-19-7-4-5-8-20(19)13-18/h4-14,16,26H,3,15H2,1-2H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007057
PNG
(1-[3-(3-Phenyl-prop-2-ynyloxy)-phenyl]-1-thiazol-2...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OCC#Cc2ccccc2)c1
Show InChI InChI=1S/C21H19NO2S/c1-2-21(23,20-22-13-15-25-20)18-11-6-12-19(16-18)24-14-7-10-17-8-4-3-5-9-17/h3-6,8-9,11-13,15-16,23H,2,14H2,1H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50007048
PNG
(2-Methyl-1-[3-(naphthalen-2-ylmethoxy)-phenyl]-1-t...)
Show SMILES CC(C)C(O)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H23NO2S/c1-17(2)24(26,23-25-12-13-28-23)21-8-5-9-22(15-21)27-16-18-10-11-19-6-3-4-7-20(19)14-18/h3-15,17,26H,16H2,1-2H3
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ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007063
PNG
(1-[3-(3,4-Dichloro-benzyloxy)-phenyl]-1-thiazol-2-...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OCc2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C19H17Cl2NO2S/c1-2-19(23,18-22-8-9-25-18)14-4-3-5-15(11-14)24-12-13-6-7-16(20)17(21)10-13/h3-11,23H,2,12H2,1H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007058
PNG
(1-Thiazol-2-yl-1-[3-(3-m-tolyl-prop-2-ynyloxy)-phe...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OCC#Cc2cccc(C)c2)c1
Show InChI InChI=1S/C22H21NO2S/c1-3-22(24,21-23-12-14-26-21)19-10-5-11-20(16-19)25-13-6-9-18-8-4-7-17(2)15-18/h4-5,7-8,10-12,14-16,24H,3,13H2,1-2H3
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n/an/a 2.50E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007062
PNG
(2-{1-Methoxy-1-[3-(naphthalen-1-ylmethoxy)-phenyl]...)
Show SMILES CCC(OC)(c1nccs1)c1cccc(OCc2cccc3ccccc23)c1
Show InChI InChI=1S/C24H23NO2S/c1-3-24(26-2,23-25-14-15-28-23)20-11-7-12-21(16-20)27-17-19-10-6-9-18-8-4-5-13-22(18)19/h4-16H,3,17H2,1-2H3
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n/an/a 4.80E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007053
PNG
(CHEMBL73720 | [3-(Naphthalen-2-ylmethoxy)-phenyl]-...)
Show SMILES OC(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C21H17NO2S/c23-20(21-22-10-11-25-21)18-6-3-7-19(13-18)24-14-15-8-9-16-4-1-2-5-17(16)12-15/h1-13,20,23H,14H2
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n/an/a 5.10E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in guinea pig.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Rattus norvegicus)
BDBM50007042
PNG
(2-{Methoxy-[3-(naphthalen-2-ylmethoxy)-phenyl]-met...)
Show SMILES COC(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H19NO2S/c1-24-21(22-23-11-12-26-22)19-7-4-8-20(14-19)25-15-16-9-10-17-5-2-3-6-18(17)13-16/h2-14,21H,15H2,1H3
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n/an/a 6.00E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in rat whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007043
PNG
((3-Decyloxy-phenyl)-(5-methyl-1H-imidazol-2-yl)-me...)
Show SMILES CCCCCCCCCCOc1cccc(c1)C(O)c1ncc(C)[nH]1
Show InChI InChI=1S/C21H32N2O2/c1-3-4-5-6-7-8-9-10-14-25-19-13-11-12-18(15-19)20(24)21-22-16-17(2)23-21/h11-13,15-16,20,24H,3-10,14H2,1-2H3,(H,22,23)
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n/an/a 6.30E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in guinea pig.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


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



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007050
PNG
(CHEMBL71399 | [3-(Biphenyl-4-ylmethoxy)-phenyl]-(5...)
Show SMILES Cc1cnc([nH]1)C(O)c1cccc(OCc2ccc(cc2)-c2ccccc2)c1
Show InChI InChI=1S/C24H22N2O2/c1-17-15-25-24(26-17)23(27)21-8-5-9-22(14-21)28-16-18-10-12-20(13-11-18)19-6-3-2-4-7-19/h2-15,23,27H,16H2,1H3,(H,25,26)
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n/an/a 7.00E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in guinea pig.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007042
PNG
(2-{Methoxy-[3-(naphthalen-2-ylmethoxy)-phenyl]-met...)
Show SMILES COC(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H19NO2S/c1-24-21(22-23-11-12-26-22)19-7-4-8-20(14-19)25-15-16-9-10-17-5-2-3-6-18(17)13-16/h2-14,21H,15H2,1H3
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n/an/a 7.00E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007041
PNG
((5-Methyl-1H-imidazol-2-yl)-[3-(naphthalen-2-ylmet...)
Show SMILES Cc1cnc([nH]1)C(O)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H20N2O2/c1-15-13-23-22(24-15)21(25)19-7-4-8-20(12-19)26-14-16-9-10-17-5-2-3-6-18(17)11-16/h2-13,21,25H,14H2,1H3,(H,23,24)
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n/an/a 7.60E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in guinea pig.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007051
PNG
(1-[3-(Naphthalen-2-ylmethoxy)-phenyl]-1-thiazol-2-...)
Show SMILES CCCC(O)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H23NO2S/c1-2-12-24(26,23-25-13-14-28-23)21-8-5-9-22(16-21)27-17-18-10-11-19-6-3-4-7-20(19)15-18/h3-11,13-16,26H,2,12,17H2,1H3
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n/an/a 8.80E+3n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007044
PNG
(1-[3-(3-Phenyl-propoxy)-phenyl]-1-thiazol-2-yl-pro...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OCCCc2ccccc2)c1
Show InChI InChI=1S/C21H23NO2S/c1-2-21(23,20-22-13-15-25-20)18-11-6-12-19(16-18)24-14-7-10-17-8-4-3-5-9-17/h3-6,8-9,11-13,15-16,23H,2,7,10,14H2,1H3
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n/an/a 1.10E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007042
PNG
(2-{Methoxy-[3-(naphthalen-2-ylmethoxy)-phenyl]-met...)
Show SMILES COC(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H19NO2S/c1-24-21(22-23-11-12-26-22)19-7-4-8-20(14-19)25-15-16-9-10-17-5-2-3-6-18(17)13-16/h2-14,21H,15H2,1H3
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n/an/a 1.20E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in guinea pig.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Mus musculus)
BDBM50007045
PNG
(2-[1-Methoxy-4-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2c1cccc2OCc1ccc2ccccc2c1)c1nccs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-25-13-14-28-23)12-11-20-21(24)7-4-8-22(20)27-16-17-9-10-18-5-2-3-6-19(18)15-17/h2-10,13-15H,11-12,16H2,1H3
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n/an/a 1.30E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in mouse macrophages.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Rattus norvegicus)
BDBM50007040
PNG
(2-[1-Methoxy-6-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2ccc(OCc3ccc4ccccc4c3)cc12)c1nccs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-25-12-13-28-23)11-10-19-8-9-21(15-22(19)24)27-16-17-6-7-18-4-2-3-5-20(18)14-17/h2-9,12-15H,10-11,16H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-LPO) in rat basophilic leukemia (RBL) cells.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Rattus norvegicus)
BDBM50007040
PNG
(2-[1-Methoxy-6-(naphthalen-2-ylmethoxy)-indan-1-yl...)
Show SMILES COC1(CCc2ccc(OCc3ccc4ccccc4c3)cc12)c1nccs1
Show InChI InChI=1S/C24H21NO2S/c1-26-24(23-25-12-13-28-23)11-10-19-8-9-21(15-22(19)24)27-16-17-6-7-18-4-2-3-5-20(18)14-17/h2-9,12-15H,10-11,16H2,1H3
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n/an/a>2.00E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-LPO) in rat basophilic leukemia (RBL) cells.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007059
PNG
(1-Thiazol-2-yl-1-[3-(3-p-tolyl-prop-2-ynyloxy)-phe...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OCC#Cc2ccc(C)cc2)c1
Show InChI InChI=1S/C22H21NO2S/c1-3-22(24,21-23-13-15-26-21)19-7-4-8-20(16-19)25-14-5-6-18-11-9-17(2)10-12-18/h4,7-13,15-16,24H,3,14H2,1-2H3
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n/an/a 2.20E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Rattus norvegicus)
BDBM50007041
PNG
((5-Methyl-1H-imidazol-2-yl)-[3-(naphthalen-2-ylmet...)
Show SMILES Cc1cnc([nH]1)C(O)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C22H20N2O2/c1-15-13-23-22(24-15)21(25)19-7-4-8-20(12-19)26-14-16-9-10-17-5-2-3-6-18(17)11-16/h2-13,21,25H,14H2,1H3,(H,23,24)
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n/an/a>3.00E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in rat whole blood.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Rattus norvegicus)
BDBM50007043
PNG
((3-Decyloxy-phenyl)-(5-methyl-1H-imidazol-2-yl)-me...)
Show SMILES CCCCCCCCCCOc1cccc(c1)C(O)c1ncc(C)[nH]1
Show InChI InChI=1S/C21H32N2O2/c1-3-4-5-6-7-8-9-10-14-25-19-13-11-12-18(15-19)20(24)21-22-16-17(2)23-21/h11-13,15-16,20,24H,3-10,14H2,1-2H3,(H,22,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in rat whole blood.


Citation and Details
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Rattus norvegicus)
BDBM50007053
PNG
(CHEMBL73720 | [3-(Naphthalen-2-ylmethoxy)-phenyl]-...)
Show SMILES OC(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C21H17NO2S/c23-20(21-22-10-11-25-21)18-6-3-7-19(13-18)24-14-15-8-9-16-4-1-2-5-17(16)12-15/h1-13,20,23H,14H2
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n/an/a 3.00E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Compound was tested for the inhibition of 5-lipoxygenase (5-Lpo) in rat whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


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



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007048
PNG
(2-Methyl-1-[3-(naphthalen-2-ylmethoxy)-phenyl]-1-t...)
Show SMILES CC(C)C(O)(c1nccs1)c1cccc(OCc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C24H23NO2S/c1-17(2)24(26,23-25-12-13-28-23)21-8-5-9-22(15-21)27-16-18-10-11-19-6-3-4-7-20(19)14-18/h3-15,17,26H,16H2,1-2H3
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n/an/a 4.00E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


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



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


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

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


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



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007047
PNG
(1-[3-(3,4-Difluoro-benzyloxy)-phenyl]-1-thiazol-2-...)
Show SMILES CCC(O)(c1nccs1)c1cccc(OCc2ccc(F)c(F)c2)c1
Show InChI InChI=1S/C19H17F2NO2S/c1-2-19(23,18-22-8-9-25-18)14-4-3-5-15(11-14)24-12-13-6-7-16(20)17(21)10-13/h3-11,23H,2,12H2,1H3
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n/an/a 4.00E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (human))
BDBM50007049
PNG
(2-{1-Methoxy-1-[2-(naphthalen-2-ylmethoxy)-phenyl]...)
Show SMILES CCC(OC)(c1nccs1)c1ccccc1OCc1ccc2ccccc2c1
Show InChI InChI=1S/C24H23NO2S/c1-3-24(26-2,23-25-14-15-28-23)21-10-6-7-11-22(21)27-17-18-12-13-19-8-4-5-9-20(19)16-18/h4-16H,3,17H2,1-2H3
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n/an/a>4.00E+4n/an/an/an/an/an/a



ICI Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human whole blood.


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%