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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-Lipoxygenase' and Monomerid = 50017002   
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))
BDBM50017002
PNG
(CHEMBL18559 | [4-(7-Chloro-4-hydroxy-3-methyl-5-pr...)
Show SMILES CCCc1cc(Cl)c2oc(Cc3ccc(OCC(O)=O)cc3)c(C)c2c1O
Show InChI InChI=1S/C21H21ClO5/c1-3-4-14-10-16(22)21-19(20(14)25)12(2)17(27-21)9-13-5-7-15(8-6-13)26-11-18(23)24/h5-8,10,25H,3-4,9,11H2,1-2H3,(H,23,24)
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Article
PubMed
n/an/a 105n/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