BDBM50496628 CHEMBL3133034

SMILES [H][C@@]12[#6]-[#6@@H](-[#6]-[#7]1-[#6](=O)-c1cc(ccc1-[#7](-[#6]-[#6]-[#7])-[#6]2=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#16]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])-[#6](=O)-[#8]-[#6])-[#7]S(=O)(=O)[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]

InChI Key InChIKey=NFUAOGQOUNFGQJ-CISJRDHLSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50496628   

TargetAcyl-protein thioesterase 1(Homo sapiens (Human))
University Of Michigan

Curated by ChEMBL
LigandPNGBDBM50496628(CHEMBL3133034)
Affinity DataIC50:  27nMAssay Description:Inhibition of APT1 (unknown origin)More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed