BDBM23102 2-(4-phenylbutoxy)-1-[5-(pyridin-2-yl)-1,3-oxazol-2-yl]ethan-1-one::alpha-ketooxazole, 12a

SMILES O=C(COCCCCc1ccccc1)c1ncc(o1)-c1ccccn1

InChI Key InChIKey=HHCOCKSGAZJTSF-UHFFFAOYSA-N

Data  1 KI  2 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 = 23102   

TargetDNA ligase 1(Homo sapiens (Human))
The Scripps Research Institute

LigandPNGBDBM23102(2-(4-phenylbutoxy)-1-[5-(pyridin-2-yl)-1,3-oxazol-...)
Affinity DataKi:  60nM ΔG°:  -9.85kcal/mole IC50:  10nMT: 2°CAssay Description:The inhibition assays were performed by incubating enzyme, 14C-labeled oleamide in reaction buffer at room temperature in the presence of three diffe...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarboxylic ester hydrolase(Homo sapiens (Human))
The Scripps Research Institute

LigandPNGBDBM23102(2-(4-phenylbutoxy)-1-[5-(pyridin-2-yl)-1,3-oxazol-...)
Affinity DataIC50:  340nMT: 2°CAssay Description:Inhibition of TGH activity was assayed using COS-7 expressed TGH and the chromogenic substrate. IC50 values were determined from the inhibition obser...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed