BDBM50112579 6-Amino-2-(2-{2-[2-(6-amino-2-{2-[2-(2-amino-3-cyclohexyl-propionylamino)-3-cyclohexyl-propionylamino]-3-cyclohexyl-propionylamino}-hexylamino)-3-phenyl-propionylamino]-3-carbamoyl-propionylamino}-3-methyl-pentanoylamino)-hexanoic acid::CHEMBL216352

SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC[C@H](CCCCN)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@@H](N)CC1CCCCC1)C(=O)N[C@@H](CCCCN)C(O)=O

InChI Key InChIKey=YPDCLFNFVCYMMY-UHFFFAOYSA-N

Data  1 KI

  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 1 hit for monomerid = 50112579   

TargetGenome polyprotein(Human rhinovirus B)
Carlsberg Laboratory

Curated by ChEMBL
LigandPNGBDBM50112579(6-Amino-2-(2-{2-[2-(6-amino-2-{2-[2-(2-amino-3-cyc...)
Affinity DataKi:  6.30E+3nMAssay Description:Inhibition of Leishmania mexicana Cysteine protease B (CPB2.8deltaCTE) was obtained in a solution-phase assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/26/2012
Entry Details Article
PubMed