BDBM50112585 2-[3-Cyclohexyl-2-(2-{2-[2-(3-(3H-imidazol-4-yl)-2-{[1-(pyrrolidine-2-carbonyl)-pyrrolidine-2-carbonyl]-amino}-propionylamino)-3-phenyl-propylamino]-3-phenyl-propionylamino}-3-methyl-pentanoylamino)-propionylamino]-3-methyl-butyric acid::CHEMBL384420

SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCCN1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](C(C)C)C(O)=O

InChI Key InChIKey=UBTGPGOCOVJAAP-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 = 50112585   

TargetGenome polyprotein(Human rhinovirus B)
Carlsberg Laboratory

Curated by ChEMBL
LigandPNGBDBM50112585(2-[3-Cyclohexyl-2-(2-{2-[2-(3-(3H-imidazol-4-yl)-2...)
Affinity DataKi:  6.60E+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