BDBM19547 (2S)-N-{2-[(4-methoxyphenyl)amino]ethyl}-4,4-dimethyl-2-[(3-methylphenyl)formamido]pentanamide::arylaminoethyl amide, 5a

SMILES COc1ccc(NCCNC(=O)[C@H](CC(C)(C)C)NC(=O)c2cccc(C)c2)cc1

InChI Key InChIKey=DRKSBIJCXVSMBY-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 19547   

TargetCathepsin S(Human)
Gnf

LigandPNGBDBM19547((2S)-N-{2-[(4-methoxyphenyl)amino]ethyl}-4,4-dimet...)
Affinity DataKi:  46nM ΔG°:  -10.4kcal/molepH: 5.5 T: 2°CAssay Description:The recombinant human cathepsin enzyme was preincubated with inhibitor for 20 minutes prior to addition of substrate. The substrate hydrolysis was mo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/18/2007
Entry Details Article
PubMed
TargetProcathepsin L(Human)
Gnf

LigandPNGBDBM19547((2S)-N-{2-[(4-methoxyphenyl)amino]ethyl}-4,4-dimet...)
Affinity DataKi:  216nMAssay Description:The recombinant human cathepsin enzyme was preincubated with inhibitor for 20 minutes prior to addition of substrate. The substrate hydrolysis was mo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/18/2007
Entry Details Article
PubMed
TargetCathepsin K(Human)
Gnf

LigandPNGBDBM19547((2S)-N-{2-[(4-methoxyphenyl)amino]ethyl}-4,4-dimet...)
Affinity DataKi:  246nMAssay Description:The recombinant human cathepsin enzyme was preincubated with inhibitor for 20 minutes prior to addition of substrate. The substrate hydrolysis was mo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/18/2007
Entry Details Article
PubMed