BDBM50112591 2-(2-{2-[2-(2-{2-[2-(2-Amino-4-methylsulfanyl-butyrylamino)-3-(1H-indol-3-yl)-propionylamino]-5-guanidino-pentanoylamino}-3-phenyl-propylamino)-propionylamino]-3-methyl-pentanoylamino}-3-methyl-pentanoylamino)-3-hydroxy-butyric acid::CHEMBL407298

SMILES CC[C@H](C)[C@H](NC(=O)[C@H](C)NC[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(O)=O

InChI Key InChIKey=LYKVIOYOXYFAIO-COAUODGLSA-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 = 50112591   

TargetGenome polyprotein(Human rhinovirus B)
Carlsberg Laboratory

Curated by ChEMBL
LigandPNGBDBM50112591(2-(2-{2-[2-(2-{2-[2-(2-Amino-4-methylsulfanyl-buty...)
Affinity DataKi:  6.50E+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 DepthDetails ArticlePubMed