BDBM7999 (2R,3R,4R,5S)-3,4-dihydroxy-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-6-{[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino}-2,5-bis(prop-2-en-1-yloxy)hexanamide::C2-symmetric compound 7

SMILES O[C@H]([C@@H](O)[C@@H](OCC=C)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)[C@H](CN[C@@H]1[C@H](O)Cc2ccccc12)OCC=C

InChI Key InChIKey=HDNRAKUAFKNZFK-KFNSJQBCSA-N

Data  3 KI

  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 3 hits for monomerid = 7999   

TargetPlasmepsin I(Plasmodium falciparum)
Uppsala University

LigandPNGBDBM7999((2R,3R,4R,5S)-3,4-dihydroxy-N-[(1S,2R)-2-hydroxy-2...)
Affinity DataKi: >1.50E+3nMAssay Description:Enzyme activities were assayed by monitoring the hydrolysis of substrate in the presence or absence of inhibitor compounds. The hydrolysis was record...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin D(Homo sapiens (Human))
Uppsala University

LigandPNGBDBM7999((2R,3R,4R,5S)-3,4-dihydroxy-N-[(1S,2R)-2-hydroxy-2...)
Affinity DataKi: >2.00E+3nMAssay Description:Enzyme activities were assayed by monitoring the hydrolysis of substrate in the presence or absence of inhibitor compounds. The hydrolysis was record...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPlasmepsin II(Plasmodium falciparum)
Uppsala University

LigandPNGBDBM7999((2R,3R,4R,5S)-3,4-dihydroxy-N-[(1S,2R)-2-hydroxy-2...)
Affinity DataKi: >2.50E+3nM ΔG°: >-7.56kcal/molepH: 4.5 T: 2°CAssay Description:Enzyme activities were assayed by monitoring the hydrolysis of substrate in the presence or absence of inhibitor compounds. The hydrolysis was record...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed