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Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with all data for assayid = 2 entry = 50027499   
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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n/an/a 228n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human recombinant leukotriene A4 hydrolase expressed in Escherichia coli assessed as p-nitroanilide release ...


Bioorg Med Chem Lett 18: 6549-52 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.044
BindingDB Entry DOI: 10.7270/Q2KS6RDK
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50246061
PNG
(4-(4-(pentyloxy)phenoxy)phenol | CHEMBL500079)
Show SMILES CCCCCOc1ccc(Oc2ccc(O)cc2)cc1
Show InChI InChI=1S/C17H20O3/c1-2-3-4-13-19-15-9-11-17(12-10-15)20-16-7-5-14(18)6-8-16/h5-12,18H,2-4,13H2,1H3
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n/an/a 2.48E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human recombinant leukotriene A4 hydrolase expressed in Escherichia coli assessed as p-nitroanilide release ...


Bioorg Med Chem Lett 18: 6549-52 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.044
BindingDB Entry DOI: 10.7270/Q2KS6RDK
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50246009
PNG
(1-(pentyloxy)-4-phenoxybenzene | CHEMBL472892)
Show SMILES CCCCCOc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C17H20O2/c1-2-3-7-14-18-15-10-12-17(13-11-15)19-16-8-5-4-6-9-16/h4-6,8-13H,2-3,7,14H2,1H3
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n/an/a 4.13E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human recombinant leukotriene A4 hydrolase expressed in Escherichia coli assessed as p-nitroanilide release ...


Bioorg Med Chem Lett 18: 6549-52 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.044
BindingDB Entry DOI: 10.7270/Q2KS6RDK
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50246011
PNG
(4-(4-butoxyphenoxy)phenol | CHEMBL467374)
Show SMILES CCCCOc1ccc(Oc2ccc(O)cc2)cc1
Show InChI InChI=1S/C16H18O3/c1-2-3-12-18-14-8-10-16(11-9-14)19-15-6-4-13(17)5-7-15/h4-11,17H,2-3,12H2,1H3
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n/an/a 5.56E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human recombinant leukotriene A4 hydrolase expressed in Escherichia coli assessed as p-nitroanilide release ...


Bioorg Med Chem Lett 18: 6549-52 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.044
BindingDB Entry DOI: 10.7270/Q2KS6RDK
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50246010
PNG
(4-(4-propoxyphenoxy)phenol | CHEMBL472893)
Show SMILES CCCOc1ccc(Oc2ccc(O)cc2)cc1
Show InChI InChI=1S/C15H16O3/c1-2-11-17-13-7-9-15(10-8-13)18-14-5-3-12(16)4-6-14/h3-10,16H,2,11H2,1H3
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n/an/a 5.69E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human recombinant leukotriene A4 hydrolase expressed in Escherichia coli assessed as p-nitroanilide release ...


Bioorg Med Chem Lett 18: 6549-52 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.044
BindingDB Entry DOI: 10.7270/Q2KS6RDK
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50246008
PNG
(1-butoxy-4-phenoxybenzene | CHEMBL475731)
Show SMILES CCCCOc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C16H18O2/c1-2-3-13-17-14-9-11-16(12-10-14)18-15-7-5-4-6-8-15/h4-12H,2-3,13H2,1H3
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n/an/a 5.72E+3n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase activity of human recombinant leukotriene A4 hydrolase expressed in Escherichia coli assessed as p-nitroanilide release ...


Bioorg Med Chem Lett 18: 6549-52 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.044
BindingDB Entry DOI: 10.7270/Q2KS6RDK
More data for this
Ligand-Target Pair