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BDBM50317480 (S)-2-(2-((4-(4-chlorophenoxy)phenoxy)methyl)piperidin-1-yl)acetic acid::CHEMBL1098170

SMILES: OC(=O)CN1CCCC[C@H]1COc1ccc(Oc2ccc(Cl)cc2)cc1

InChI Key: InChIKey=UONPGQMBZPLCLV-INIZCTEOSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50317480   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50317480
PNG
((S)-2-(2-((4-(4-chlorophenoxy)phenoxy)methyl)piper...)
Show SMILES OC(=O)CN1CCCC[C@H]1COc1ccc(Oc2ccc(Cl)cc2)cc1 |r|
Show InChI InChI=1S/C20H22ClNO4/c21-15-4-6-18(7-5-15)26-19-10-8-17(9-11-19)25-14-16-3-1-2-12-22(16)13-20(23)24/h4-11,16H,1-3,12-14H2,(H,23,24)/t16-/m0/s1
PDB
MMDB

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Article
PubMed
n/an/a 880n/an/an/an/an/an/a



deCODE Chemistry, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human recombinant LTA4H hydrolysis assessed as inhibition of LTB4 formation by LC-MS/MS


Bioorg Med Chem Lett 20: 2851-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.047
BindingDB Entry DOI: 10.7270/Q2CC10VD
More data for this
Ligand-Target Pair