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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-Lipoxygenase' and Monomerid = 50017001   
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


(Homo sapiens (Human))
BDBM50017001
PNG
(7-Chloro-2-(2,4-dimethoxy-benzyl)-3-methyl-5-propy...)
Show SMILES CCCc1cc(Cl)c2oc(Cc3ccc(OC)cc3OC)c(C)c2c1O
Show InChI InChI=1S/C21H23ClO4/c1-5-6-14-9-16(22)21-19(20(14)23)12(2)17(26-21)10-13-7-8-15(24-3)11-18(13)25-4/h7-9,11,23H,5-6,10H2,1-4H3
PDB
MMDB

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PC sid
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Similars

Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Merck Frosst Canada Inc.

Curated by ChEMBL


Assay Description
Concentration required for 50 % inhibition of leukotriene B4 production in human PMN compared with controls in the absence of compound


J Med Chem 32: 1190-7 (1989)


Article DOI: 10.1021/jm00126a008
BindingDB Entry DOI: 10.7270/Q2ST7NVR
More data for this
Ligand-Target Pair