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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 246.2
BDBM50046338

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))
BDBM50046338
PNG
(3,3-Difluoro-4-(5-methyl-1H-imidazol-4-yl)-4-oxo-b...)
Show SMILES CCOC(=O)CC(F)(F)C(=O)c1[nH]cnc1C
Show InChI InChI=1S/C10H12F2N2O3/c1-3-17-7(15)4-10(11,12)9(16)8-6(2)13-5-14-8/h5H,3-4H2,1-2H3,(H,13,14)
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of amidase activity of LTA4 hydrolase purified from human leukocytes


J Med Chem 36: 211-20 (1993)


BindingDB Entry DOI: 10.7270/Q2T152P3
More data for this
Ligand-Target Pair