BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 445.5
BDBM50251520

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

Found 2 hits 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))
BDBM50251520
PNG
(4-((4-(2-oxo-2-(4-phenoxyphenylamino)ethyl)piperaz...)
Show SMILES OC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)cc1
Show InChI InChI=1S/C26H27N3O4/c30-25(27-22-10-12-24(13-11-22)33-23-4-2-1-3-5-23)19-29-16-14-28(15-17-29)18-20-6-8-21(9-7-20)26(31)32/h1-13H,14-19H2,(H,27,30)(H,31,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a



Berlex Biosciences

Curated by ChEMBL


Assay Description
Inhibition of LTA4 hydrolase (unknown origin) by whole blood assay


Bioorg Med Chem Lett 18: 3891-4 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.046
BindingDB Entry DOI: 10.7270/Q20P0ZTV
More data for this
Ligand-Target Pair
Leukotriene A-4 hydrolase


(Homo sapiens (Human))
BDBM50251520
PNG
(4-((4-(2-oxo-2-(4-phenoxyphenylamino)ethyl)piperaz...)
Show SMILES OC(=O)c1ccc(CN2CCN(CC(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)cc1
Show InChI InChI=1S/C26H27N3O4/c30-25(27-22-10-12-24(13-11-22)33-23-4-2-1-3-5-23)19-29-16-14-28(15-17-29)18-20-6-8-21(9-7-20)26(31)32/h1-13H,14-19H2,(H,27,30)(H,31,32)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Berlex Biosciences

Curated by ChEMBL


Assay Description
Inhibition of LTA4 hydrolase (unknown origin) by hydrolase assay


Bioorg Med Chem Lett 18: 3891-4 (2008)


Article DOI: 10.1016/j.bmcl.2008.06.046
BindingDB Entry DOI: 10.7270/Q20P0ZTV
More data for this
Ligand-Target Pair