BDBM50046412 CHEMBL113626::N-{1-Benzyl-2-hydroxy-3-[3-methyl-2-(3-pyridin-3-yl-acryloylamino)-butyrylamino]-4-phenyl-butyl}-3-methyl-2-(3-pyridin-3-yl-acryloylamino)-butyramide

SMILES CC(C)[C@H](NC(=O)\C=C\c1cccnc1)C(=O)N[C@@H](Cc1ccccc1)C(O)[C@H](Cc1ccccc1)NC(=O)[C@H](NC(=O)\C=C\c1cccnc1)C(C)C

InChI Key InChIKey=CTEIKHWGBFKWFC-SBTGMTKMSA-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 = 50046412   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50046412(CHEMBL113626 | N-{1-Benzyl-2-hydroxy-3-[3-methyl-2...)
Affinity DataIC50:  2.20nMAssay Description:Inhibition of purified recombinant HIV-1 protease in a fluorogenic assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed