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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-Lipoxygenase' and Monomerid = 50053550   
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))
BDBM50053550
PNG
(7-[3-(4-Hydroxy-tetrahydro-pyran-4-yl)-benzyloxy]-...)
Show SMILES CC1(C)OC(=O)c2cc3cc(OCc4cccc(c4)C4(O)CCOCC4)ccc3c(c12)-c1ccccc1
Show InChI InChI=1S/C32H30O5/c1-31(2)29-27(30(33)37-31)19-23-18-25(11-12-26(23)28(29)22-8-4-3-5-9-22)36-20-21-7-6-10-24(17-21)32(34)13-15-35-16-14-32/h3-12,17-19,34H,13-16,20H2,1-2H3
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Similars

Article
PubMed
n/an/a>6.00E+3n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Potency to inhibit oxidation of arachidonic acid by recombinant human 5-lipoxygenase


J Med Chem 39: 3951-70 (1996)


Article DOI: 10.1021/jm960301c
BindingDB Entry DOI: 10.7270/Q2639QCJ
More data for this
Ligand-Target Pair