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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-Lipoxygenase' and Monomerid = 50031136   
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))
BDBM50031136
PNG
(1-{4-[3-Fluoro-5-(4-methoxy-tetrahydro-pyran-4-yl)...)
Show SMILES COC1(CCOCC1)c1cc(Sc2ccc(cc2)C(C)N=O)cc(F)c1C
Show InChI InChI=1/C21H24FNO3S/c1-14-19(21(25-3)8-10-26-11-9-21)12-18(13-20(14)22)27-17-6-4-16(5-7-17)15(2)23-24/h4-7,12-13,15H,8-11H2,1-3H3
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Zeneca Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of LT biosynthesis in vitro using A-23,187-stimulated human whole blood.


J Med Chem 38: 3951-6 (1995)


Article DOI: 10.1021/jm00020a008
BindingDB Entry DOI: 10.7270/Q22J69WD
More data for this
Ligand-Target Pair