BDBM50146771 3-Hydroxy-6-methyl-4-(3-methyl-2-{2-[(E)-2-(6-vinyl-cyclohexa-2,4-dienyl)-vinyloxy]-acetylamino}-pentanoylamino)-heptanoic acid butylamide::CHEMBL421386

SMILES C=CC1C=CC=CC1/C=C/OCC(=O)NC(C(=O)NC(CC(C)C)C(O)CC(=O)NCCCC)C(C)CC

InChI Key InChIKey=LKRKFZSBAJDUFF-UHFFFAOYSA-N

Data  2 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50146771   

TargetPlasmepsin II(Plasmodium falciparum)
Universitat Pompeu Fabra

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50146771BDBM50146771(3-Hydroxy-6-methyl-4-(3-methyl-2-{2-[(E)-2-(6-viny...)
Affinity DataKi:  110nMAssay Description:Binding affinity towards plasmepsin-2 in Plasmodium falciparum.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed
TargetCathepsin D(Human)
Universitat Pompeu Fabra

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50146771BDBM50146771(3-Hydroxy-6-methyl-4-(3-methyl-2-{2-[(E)-2-(6-viny...)
Affinity DataKi:  560nMAssay Description:Binding affinity towards human cathepsin D.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/30/2012
Entry Details Article
PubMed