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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Leukotriene A4 hydrolase' and Ligand = 'BDBM50285634'   
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 A4 hydrolase


(Homo sapiens (Human))
BDBM50285634
PNG
((R)-1-((R)-2-Benzyl-3-hydroxycarbamoyl-propionyl)-...)
Show SMILES ONC(=O)C[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1C(O)=O
Show InChI InChI=1S/C17H22N2O5/c20-15(18-24)11-13(10-12-6-2-1-3-7-12)16(21)19-9-5-4-8-14(19)17(22)23/h1-3,6-7,13-14,24H,4-5,8-11H2,(H,18,20)(H,22,23)/t13-,14-/m1/s1
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Article
n/an/a 1.80E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant human Leukotriene A4 hydrolase


Bioorg Med Chem Lett 5: 2517-2522 (1995)


Article DOI: 10.1016/0960-894X(95)00441-U
BindingDB Entry DOI: 10.7270/Q2959J1M
More data for this
Ligand-Target Pair
Leukotriene A4 hydrolase


(Homo sapiens (Human))
BDBM50285634
PNG
((R)-1-((R)-2-Benzyl-3-hydroxycarbamoyl-propionyl)-...)
Show SMILES ONC(=O)C[C@@H](Cc1ccccc1)C(=O)N1CCCC[C@@H]1C(O)=O
Show InChI InChI=1S/C17H22N2O5/c20-15(18-24)11-13(10-12-6-2-1-3-7-12)16(21)19-9-5-4-8-14(19)17(22)23/h1-3,6-7,13-14,24H,4-5,8-11H2,(H,18,20)(H,22,23)/t13-,14-/m1/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



Gyeongsang National University (GNU)

Curated by ChEMBL


Assay Description
Inhibition of human leukotriene A4 hydrolase


Eur J Med Chem 46: 1593-603 (2011)


Article DOI: 10.1016/j.ejmech.2011.02.007
BindingDB Entry DOI: 10.7270/Q2K64JDG
More data for this
Ligand-Target Pair