BDBM19685 (2S)-4,4-dimethyl-1-(morpholin-4-yl)-1-oxopentan-2-yl N-[(2S)-1-{[4-(trifluoromethoxy)phenyl]amino}propan-2-yl]carbamate::Arylaminoethyl carbamate, 16

SMILES C[C@@H](CNc1ccc(OC(F)(F)F)cc1)NC(=O)O[C@@H](CC(C)(C)C)C(=O)N1CCOCC1

InChI Key InChIKey=VVPSHHIMDSUHCQ-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 19685   

TargetCathepsin K(Human)
Gnf

LigandPNGBDBM19685((2S)-4,4-dimethyl-1-(morpholin-4-yl)-1-oxopentan-2...)
Affinity DataKi:  355nMAssay 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

LigandPNGBDBM19685((2S)-4,4-dimethyl-1-(morpholin-4-yl)-1-oxopentan-2...)
Affinity DataKi:  1.05E+3nM ΔG°:  -8.48kcal/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

LigandPNGBDBM19685((2S)-4,4-dimethyl-1-(morpholin-4-yl)-1-oxopentan-2...)
Affinity DataKi: >1.00E+5nMAssay 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