BDBM19588 (2S)-N-{2-[(4-chlorophenyl)amino]ethyl}-4-methyl-2-[(3-methylphenyl)formamido]pentanamide::arylaminoethyl amide, 3d

SMILES CC(C)C[C@H](NC(=O)c1cccc(C)c1)C(=O)NCCNc1ccc(Cl)cc1

InChI Key InChIKey=JAFPZYCIYCKDRH-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 19588   

TargetProcathepsin L(Human)
Gnf

LigandPNGBDBM19588((2S)-N-{2-[(4-chlorophenyl)amino]ethyl}-4-methyl-2...)
Affinity DataKi:  92nMAssay 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

LigandPNGBDBM19588((2S)-N-{2-[(4-chlorophenyl)amino]ethyl}-4-methyl-2...)
Affinity DataKi:  408nMAssay 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 S(Human)
Gnf

LigandPNGBDBM19588((2S)-N-{2-[(4-chlorophenyl)amino]ethyl}-4-methyl-2...)
Affinity DataKi:  458nM ΔG°:  -8.99kcal/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