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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 349.4
BDBM24297

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))
BDBM24297
PNG
((4S)-4-amino-N-(4-phenoxyphenyl)-5-(1H-pyrrol-1-yl...)
Show SMILES N[C@@H](CCC(=O)Nc1ccc(Oc2ccccc2)cc1)Cn1cccc1 |r|
Show InChI InChI=1S/C21H23N3O2/c22-17(16-24-14-4-5-15-24)8-13-21(25)23-18-9-11-20(12-10-18)26-19-6-2-1-3-7-19/h1-7,9-12,14-15,17H,8,13,16,22H2,(H,23,25)/t17-/m0/s1
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PC cid
PC sid
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Article
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n/an/a 390n/an/an/an/an/an/a



Berlex Biosciences



Assay Description
Compound potency against the peptidase activity of LTA4 hydrolase was measured by inhibition of the hydrolysis of L-alanine-p-nitroanilide to L-alani...


Bioorg Med Chem 16: 4963-83 (2008)


Article DOI: 10.1016/j.bmc.2008.03.042
BindingDB Entry DOI: 10.7270/Q2BP013C
More data for this
Ligand-Target Pair