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PubMed code 19090779

Compile data set for download or QSAR
Found 12 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
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50246062
PNG
(2-(4-phenoxyphenoxy)ethanamine | CHEMBL472386)
Show SMILES NCCOc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C14H15NO2/c15-10-11-16-12-6-8-14(9-7-12)17-13-4-2-1-3-5-13/h1-9H,10-11,15H2
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PubMed
n/an/a 35n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase activity of human leukotriene A4 hydrolase assessed as LTB4 level by ELISA


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50246062
PNG
(2-(4-phenoxyphenoxy)ethanamine | CHEMBL472386)
Show SMILES NCCOc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C14H15NO2/c15-10-11-16-12-6-8-14(9-7-12)17-13-4-2-1-3-5-13/h1-9H,10-11,15H2
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n/an/a 228n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human leukotriene A4 hydrolase assessed as para-nitroanilide release by spectrophotometry


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Phospholipase A2, membrane associated


(Homo sapiens (Human))
BDBM50246062
PNG
(2-(4-phenoxyphenoxy)ethanamine | CHEMBL472386)
Show SMILES NCCOc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C14H15NO2/c15-10-11-16-12-6-8-14(9-7-12)17-13-4-2-1-3-5-13/h1-9H,10-11,15H2
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n/an/a 7.30E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human nonpancreatic secretory phospholipase A2


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50247069
PNG
(2-(7-(benzyloxy)-1H-indol-3-yl)ethanamine | CHEMBL...)
Show SMILES NCCc1c[nH]c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C17H18N2O/c18-10-9-14-11-19-17-15(14)7-4-8-16(17)20-12-13-5-2-1-3-6-13/h1-8,11,19H,9-10,12,18H2
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n/an/a 1.25E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human leukotriene A4 hydrolase assessed as para-nitroanilide release by spectrophotometry


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50247033
PNG
(2-amino-3-(5-(benzyloxy)-1H-indol-3-yl)propanoic a...)
Show SMILES NC(Cc1c[nH]c2ccc(OCc3ccccc3)cc12)C(O)=O
Show InChI InChI=1S/C18H18N2O3/c19-16(18(21)22)8-13-10-20-17-7-6-14(9-15(13)17)23-11-12-4-2-1-3-5-12/h1-7,9-10,16,20H,8,11,19H2,(H,21,22)
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n/an/a 1.73E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human leukotriene A4 hydrolase assessed as para-nitroanilide release by spectrophotometry


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50247034
PNG
(4-(4-Nitro-benzyl)-1-(2-oxo-2-phenyl-ethyl)-pyridi...)
Show SMILES [O-][N+](=O)c1ccc(Cc2cc[n+](CC(=O)c3ccccc3)cc2)cc1
Show InChI InChI=1S/C20H17N2O3/c23-20(18-4-2-1-3-5-18)15-21-12-10-17(11-13-21)14-16-6-8-19(9-7-16)22(24)25/h1-13H,14-15H2/q+1
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n/an/a 2.34E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human leukotriene A4 hydrolase assessed as para-nitroanilide release by spectrophotometry


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Phospholipase A2, membrane associated


(Homo sapiens (Human))
BDBM50247033
PNG
(2-amino-3-(5-(benzyloxy)-1H-indol-3-yl)propanoic a...)
Show SMILES NC(Cc1c[nH]c2ccc(OCc3ccccc3)cc12)C(O)=O
Show InChI InChI=1S/C18H18N2O3/c19-16(18(21)22)8-13-10-20-17-7-6-14(9-15(13)17)23-11-12-4-2-1-3-5-12/h1-7,9-10,16,20H,8,11,19H2,(H,21,22)
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n/an/a 4.21E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human nonpancreatic secretory phospholipase A2


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Phospholipase A2, membrane associated


(Homo sapiens (Human))
BDBM50247034
PNG
(4-(4-Nitro-benzyl)-1-(2-oxo-2-phenyl-ethyl)-pyridi...)
Show SMILES [O-][N+](=O)c1ccc(Cc2cc[n+](CC(=O)c3ccccc3)cc2)cc1
Show InChI InChI=1S/C20H17N2O3/c23-20(18-4-2-1-3-5-18)15-21-12-10-17(11-13-21)14-16-6-8-19(9-7-16)22(24)25/h1-13H,14-15H2/q+1
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n/an/a 4.37E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human nonpancreatic secretory phospholipase A2


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Phospholipase A2, membrane associated


(Homo sapiens (Human))
BDBM50247069
PNG
(2-(7-(benzyloxy)-1H-indol-3-yl)ethanamine | CHEMBL...)
Show SMILES NCCc1c[nH]c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C17H18N2O/c18-10-9-14-11-19-17-15(14)7-4-8-16(17)20-12-13-5-2-1-3-6-13/h1-8,11,19H,9-10,12,18H2
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PubMed
n/an/a 5.25E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of human nonpancreatic secretory phospholipase A2


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50247069
PNG
(2-(7-(benzyloxy)-1H-indol-3-yl)ethanamine | CHEMBL...)
Show SMILES NCCc1c[nH]c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C17H18N2O/c18-10-9-14-11-19-17-15(14)7-4-8-16(17)20-12-13-5-2-1-3-6-13/h1-8,11,19H,9-10,12,18H2
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Article
PubMed
n/an/a 2.17E+5n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase activity of human leukotriene A4 hydrolase assessed as LTB4 level by ELISA


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50247033
PNG
(2-amino-3-(5-(benzyloxy)-1H-indol-3-yl)propanoic a...)
Show SMILES NC(Cc1c[nH]c2ccc(OCc3ccccc3)cc12)C(O)=O
Show InChI InChI=1S/C18H18N2O3/c19-16(18(21)22)8-13-10-20-17-7-6-14(9-15(13)17)23-11-12-4-2-1-3-5-12/h1-7,9-10,16,20H,8,11,19H2,(H,21,22)
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PubMed
n/an/a 2.31E+5n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase activity of human leukotriene A4 hydrolase assessed as LTB4 level by ELISA


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50247034
PNG
(4-(4-Nitro-benzyl)-1-(2-oxo-2-phenyl-ethyl)-pyridi...)
Show SMILES [O-][N+](=O)c1ccc(Cc2cc[n+](CC(=O)c3ccccc3)cc2)cc1
Show InChI InChI=1S/C20H17N2O3/c23-20(18-4-2-1-3-5-18)15-21-12-10-17(11-13-21)14-16-6-8-19(9-7-16)22(24)25/h1-13H,14-15H2/q+1
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n/an/a 3.86E+5n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of epoxide hydrolase activity of human leukotriene A4 hydrolase assessed as LTB4 level by ELISA


J Med Chem 51: 7882-8 (2008)


Article DOI: 10.1021/jm8010096
BindingDB Entry DOI: 10.7270/Q2VH5NQQ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%