BDBM50004598 CHEMBL322454::[4-(3-{[2-(Methoxycarbonyl-phenylacetylamino-methyl)-5,5-dimethyl-thiazolidine-4-carbonyl]-amino}-propylcarbamoyl)-5,5-dimethyl-thiazolidin-2-yl]-phenylacetylamino-acetic acid methyl ester

SMILES COC(=O)[C@@H](NC(=O)Cc1ccccc1)[C@@H]1N[C@@H](C(=O)NCCCNC(=O)[C@@H]2N[C@H](SC2(C)C)[C@H](NC(=O)Cc2ccccc2)C(=O)OC)C(C)(C)S1

InChI Key InChIKey=OLBYKPSKFRRWFT-UHFFFAOYSA-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 = 50004598   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Glaxo Group Research

Curated by ChEMBL
LigandPNGBDBM50004598(CHEMBL322454 | [4-(3-{[2-(Methoxycarbonyl-phenylac...)
Affinity DataIC50: 1.20E+4nMAssay Description:Inhibitory activity towards HIV-1 proteaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed