BDBM222277 5-(3-Chloro-4-methyl-phenyl)-4-[2-(3-chloro-4-methyl-phenyl)-2-oxo-ethyl)-2-methyl-furan-3-carboxylic acid methyl ester (3i)

SMILES COC(=O)c1c(C)oc(c1CC(=O)c1ccc(C)c(Cl)c1)-c1ccc(C)c(Cl)c1

InChI Key InChIKey=ZRGAMIBNVRDBCF-UHFFFAOYSA-N

Data  1 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 222277   

TargetLipoxygenase(Glycine max (Soybean))
Csir-Indian Institute Of Chemical Biology

LigandPNGBDBM222277(5-(3-Chloro-4-methyl-phenyl)-4-[2-(3-chloro-4-meth...)
Affinity DataKi:  357nMAssay Description:The crystal structure of soybean lipoxygenase-1 (PDB code: 3PZW), was used in our docking experiments. The 3D structure of 3PZW was reported by Chrus...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetSeed linoleate 13S-lipoxygenase-1(Glycine max (soybean))
Csir-Indian Institute Of Chemical Biology

LigandPNGBDBM222277(5-(3-Chloro-4-methyl-phenyl)-4-[2-(3-chloro-4-meth...)
Affinity DataIC50:  4.75E+4nMpH: 8.0Assay Description:SLO inhibition was studied by spectrophotometric assay by measuring the change in the absorbance at 234 nm due to formation of hydroperoxylinoleic ac...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed