BDBM50055588 CHEMBL301219::N-(1H-Benzoimidazol-2-yl)-3-((4R,5S,6S,7R)-4,7-dibenzyl-3-cyclopropylmethyl-5,6-dihydroxy-2-oxo-[1,3]diazepan-1-ylmethyl)-benzamide

SMILES O[C@@H]1[C@@H](O)[C@@H](Cc2ccccc2)N(Cc2cccc(c2)C(=O)Nc2nc3ccccc3[nH]2)C(=O)N(CC2CC2)[C@@H]1Cc1ccccc1

InChI Key InChIKey=KTZXIYPLRZIZDJ-UHFFFAOYSA-N

Data  1 KI

  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 = 50055588   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Dupont Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50055588(N-(1H-Benzoimidazol-2-yl)-3-((4R,5S,6S,7R)-4,7-dib...)
Affinity DataKi:  0.0370nMAssay Description:Binding affinity to inhibit the purified wild-type HIV-1 ProteaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed