BDBM1199 2-Aminobenzyl-Substituted AHPPA deriv. 14::tert-butyl N-[(2S,3R,4R)-4-{[(4-{[3-(1H-1,3-benzodiazol-2-yl)propanamido]methyl}phenyl)methyl]amino}-4-(benzylcarbamoyl)-3-hydroxy-1-phenylbutan-2-yl]carbamate

SMILES CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)[C@@H](NCc1ccc(CNC(=O)CCc2nc3ccccc3[nH]2)cc1)C(=O)NCc1ccccc1

InChI Key InChIKey=JANCESINOVSQRO-LVCCDNIOSA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 1199   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Sandoz Forschungsinstitut Ges.M.B.H.

Curated by ChEMBL
LigandPNGBDBM1199(2-Aminobenzyl-Substituted AHPPA deriv. 14 | tert-b...)
Affinity DataKi:  676nMAssay Description:Inhibitory activity was determined against HIV type 1 proteaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDimer of Gag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Sandoz Research Institute

LigandPNGBDBM1199(2-Aminobenzyl-Substituted AHPPA deriv. 14 | tert-b...)
Affinity DataKi:  680nM ΔG°:  -8.75kcal/molepH: 6.25 T: 2°CAssay Description:Enzymatic activity was measured by following cleavage of the substrate H-Lys-Ala-Arg-Val-Leu-pNph-Glu-Ala-Nle-NH2. Products of the cleavage reaction ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed