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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Arachidonate 5-lipoxygenase' and Ligand = 'BDBM50043372'   
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
Arachidonate 5-lipoxygenase


(Bos taurus)
BDBM50043372
PNG
((E)-1,8-Dihydroxy-10-[3-(4-nitro-phenyl)-acryloyl]...)
Show SMILES Oc1cccc2C(C(=O)C=Cc3ccc(cc3)[N+]([O-])=O)c3cccc(O)c3C(=O)c12 |w:10.10|
Show InChI InChI=1S/C23H15NO6/c25-17-5-1-3-15-20(16-4-2-6-18(26)22(16)23(28)21(15)17)19(27)12-9-13-7-10-14(11-8-13)24(29)30/h1-12,20,25-26H
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
n/an/a 6.00E+3n/an/an/an/an/an/a



Universität Regensburg

Curated by ChEMBL


Assay Description
Inhibitory activity against 5-lipoxygenase (inhibition of 5-HETE and LTB4 biosynthesis) in bovine polymorphonuclear leukocytes (PMNL).


J Med Chem 36: 4099-107 (1994)


BindingDB Entry DOI: 10.7270/Q2G44PC2
More data for this
Ligand-Target Pair