BDBM19799 4-amidotetrahydropyran-3-one, 4::benzyl N-[(1S)-3-methyl-1-[(3-oxooxan-4-yl)carbamoyl]butyl]carbamate

SMILES CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NC1CCOCC1=O

InChI Key InChIKey=QURFFOZMRDDRRV-LYKKTTPLSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 19799   

TargetCathepsin K(Homo sapiens (Human))
Gsk

LigandPNGBDBM19799(4-amidotetrahydropyran-3-one, 4 | benzyl N-[(1S)-3...)
Affinity DataKi:  150nM ΔG°:  -9.21kcal/molepH: 5.5 T: 2°CAssay Description:Assays were carried out in the presence of variable concentrations of test compound. Reactions were initiated by addition of enzyme to buffered solut...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin S(Homo sapiens (Human))
Gsk

LigandPNGBDBM19799(4-amidotetrahydropyran-3-one, 4 | benzyl N-[(1S)-3...)
Affinity DataKi:  530nMAssay Description:Assays were carried out in the presence of variable concentrations of test compound. Reactions were initiated by addition of enzyme to buffered solut...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProcathepsin L(Homo sapiens (Human))
Gsk

LigandPNGBDBM19799(4-amidotetrahydropyran-3-one, 4 | benzyl N-[(1S)-3...)
Affinity DataKi:  850nMAssay Description:Assays were carried out in the presence of variable concentrations of test compound. Reactions were initiated by addition of enzyme to buffered solut...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin B(Homo sapiens (Human))
Gsk

LigandPNGBDBM19799(4-amidotetrahydropyran-3-one, 4 | benzyl N-[(1S)-3...)
Affinity DataKi: >1.00E+4nM ΔG°: >-6.75kcal/molepH: 5.5 T: 2°CAssay Description:Assays were carried out in the presence of variable concentrations of test compound. Reactions were initiated by addition of enzyme to buffered solut...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed