BDBM19614 (2S)-2-(1,3-benzoxazol-2-ylamino)-3-cyclohexyl-N-{2-[(4-methoxyphenyl)amino]ethyl}propanamide::Heterocyclic arylaminoethyl amide, 3

SMILES COc1ccc(NCCNC(=O)[C@H](CC2CCCCC2)Nc2nc3ccccc3o2)cc1

InChI Key InChIKey=VFNWTXUFNNOQHD-QFIPXVFZSA-N

Data  3 KI

PDB links: 1 PDB ID matches this monomer.

  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 = 19614   

TargetCathepsin S(Homo sapiens (Human))
Gnf

LigandPNGBDBM19614((2S)-2-(1,3-benzoxazol-2-ylamino)-3-cyclohexyl-N-{...)
Affinity DataKi:  29nM ΔG°:  -10.7kcal/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
TargetProcathepsin L(Homo sapiens (Human))
Gnf

LigandPNGBDBM19614((2S)-2-(1,3-benzoxazol-2-ylamino)-3-cyclohexyl-N-{...)
Affinity DataKi: >1.00E+4nMAssay 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 DepthDetails ArticlePubMed
TargetCathepsin K(Homo sapiens (Human))
Gnf

LigandPNGBDBM19614((2S)-2-(1,3-benzoxazol-2-ylamino)-3-cyclohexyl-N-{...)
Affinity DataKi: >3.00E+4nMAssay 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 DepthDetails ArticlePubMed