BDBM7985 (3S,4S)-5-[(4-bromophenyl)methoxy]-N-butyl-3-hydroxy-4-[(2S)-3-methyl-2-(pyridin-2-ylformamido)butanamido]pentanamide::CHEMBL114278::Pyridine-2-carboxylic Acid {(S)-1-[(1S,2S)-1-(4-Bromobenzyloxymethyl)-3-butylcarbamoyl-2-hydroxypropylcarbamoyl]-2-methylpropyl}amide::Statine-like inhibitor 24

SMILES CCCCNC(=O)C[C@H](O)[C@H](COCc1ccc(Br)cc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C

InChI Key InChIKey=LYOALEBGXHPTDB-UHFFFAOYSA-N

Data  6 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 6 hits for monomerid = 7985   

TargetPlasmepsin I(malaria parasite P. falciparum)
Linkoping University

LigandPNGBDBM7985(CHEMBL114278 | Pyridine-2-carboxylic Acid {(S)-1-[...)
Affinity DataKi:  8.10nMAssay 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 Depth
Date in BDB:
3/6/2006
Entry Details Article
PubMed
TargetPlasmepsin I(malaria parasite P. falciparum)
Linkoping University

LigandPNGBDBM7985(CHEMBL114278 | Pyridine-2-carboxylic Acid {(S)-1-[...)
Affinity DataKi:  8.10nMAssay Description:Inhibitory concentration against the plasmepsin-1 of Plasmodium falciparumMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetPlasmepsin II(Plasmodium falciparum)
Linkoping University

LigandPNGBDBM7985(CHEMBL114278 | Pyridine-2-carboxylic Acid {(S)-1-[...)
Affinity DataKi:  68nM ΔG°:  -9.67kcal/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 Depth
Date in BDB:
3/6/2006
Entry Details Article
PubMed
TargetPlasmepsin II(Plasmodium falciparum)
Linkoping University

LigandPNGBDBM7985(CHEMBL114278 | Pyridine-2-carboxylic Acid {(S)-1-[...)
Affinity DataKi:  68nMAssay Description:Inhibitory concentration against the plasmepsin-2 of Plasmodium falciparumMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCathepsin D(Human)
Linkoping University

LigandPNGBDBM7985(CHEMBL114278 | Pyridine-2-carboxylic Acid {(S)-1-[...)
Affinity DataKi:  473nMAssay 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 Depth
Date in BDB:
3/6/2006
Entry Details Article
PubMed
TargetCathepsin D(Human)
Linkoping University

LigandPNGBDBM7985(CHEMBL114278 | Pyridine-2-carboxylic Acid {(S)-1-[...)
Affinity DataKi:  473nMAssay Description:Inhibitory concentration against the human Cathepsin DMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed