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1 similar compounds to monomer 50447177

Compile data set for download or QSAR
Wt: 386.4
BDBM50447204

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50447204   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
12-Lipoxygenase (12-LOX)


(Homo sapiens (Human))
BDBM50447204
PNG
(CHEMBL3113190)
Show SMILES COc1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2ncccn2)c1O
Show InChI InChI=1S/C18H18N4O4S/c1-26-16-5-2-4-13(17(16)23)12-21-14-6-8-15(9-7-14)27(24,25)22-18-19-10-3-11-20-18/h2-11,21,23H,12H2,1H3,(H,19,20,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



National Institutes of Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His6-tagged human platelet 12-LOX using arachidonic acid as substrate by UV-vis spectrophotometric analysis


J Med Chem 57: 495-506 (2014)


Article DOI: 10.1021/jm4016476
BindingDB Entry DOI: 10.7270/Q27082XR
More data for this
Ligand-Target Pair