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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 310.3
BDBM50085278

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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))
BDBM50085278
PNG
(CHEMBL162984 | N-[4-(2-Pyrrolidin-1-yl-ethoxy)-phe...)
Show SMILES O=C(Nc1ccc(OCCN2CCCC2)cc1)c1ccccc1
Show InChI InChI=1S/C19H22N2O2/c22-19(16-6-2-1-3-7-16)20-17-8-10-18(11-9-17)23-15-14-21-12-4-5-13-21/h1-3,6-11H,4-5,12-15H2,(H,20,22)
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MMDB

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PC cid
PC sid
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Similars

PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



Searle Research and Development

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against Leukotriene A4 hydrolase


J Med Chem 43: 721-35 (2000)


BindingDB Entry DOI: 10.7270/Q2CN74MZ
More data for this
Ligand-Target Pair