BDBM50122897 (5R,8S,11S,14S,17S,20S)-20-acetamido-14-benzhydryl-11,17-bis(2-carboxyethyl)-8-(cyclohexylmethyl)-5-(mercaptomethyl)-4,7,10,13,16,19-hexaoxo-1-phenyl-3,6,9,12,15,18-hexaazadocosan-22-oic acid::4-(2-Acetylamino-3-carboxy-propionylamino)-4-(1-{1-[2-cyclohexyl-1-(2-mercapto-1-phenethylcarbamoyl-ethylcarbamoyl)-ethylcarbamoyl]-3-methoxycarbonyl-propylcarbamoyl}-2,2-diphenyl-ethylcarbamoyl)-butyric acid::CHEMBL265015

SMILES CC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C(c1ccccc1)c1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CS)C(=O)NCCc1ccccc1

InChI Key InChIKey=MAYPPTYEEGIGNJ-VUKWIJDPSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50122897   

TargetGenome polyprotein/Non-structural protein 4A(Hepatitis C virus)
Mrl Rome

Curated by ChEMBL
LigandPNGBDBM50122897((5R,8S,11S,14S,17S,20S)-20-acetamido-14-benzhydryl...)
Affinity DataIC50:  7nMAssay Description:Inhibitory activity against Hepatitis C NS3/NS4A proteaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed