BDBM25135 2-cyano-pyrropyrimidine, 7a::7-(2-cyclohexylethyl)-6-[4-(4-acetylpiperazin-1-yl)-2-fluorophenoxymethyl]-7H-pyrrolo[2,3-d]pyrimidine-2-carbonitrile

SMILES CC(=O)N1CCN(CC1)c1ccc(OCc2cc3cnc(nc3n2CCC2CCCCC2)C#N)c(F)c1

InChI Key InChIKey=RKKQUNNKTWJTLY-UHFFFAOYSA-N

Data  6 IC50

  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 6 hits for monomerid = 25135   

TargetCathepsin S(Homo sapiens (Human))
Novartis

LigandPNGBDBM25135(2-cyano-pyrropyrimidine, 7a | 7-(2-cyclohexylethyl...)
Affinity DataIC50:  18nMpH: 7.0 T: 2°CAssay Description:The substrate hydrolysis with or without inhibitor was monitored at an excitation wavelength of 360nm and an emission wavelength of 460 nm on a fluor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin S(Mus musculus (Mouse))
Novartis

LigandPNGBDBM25135(2-cyano-pyrropyrimidine, 7a | 7-(2-cyclohexylethyl...)
Affinity DataIC50:  14nMpH: 7.0 T: 2°CAssay Description:The substrate hydrolysis with or without inhibitor was monitored at an excitation wavelength of 360nm and an emission wavelength of 460 nm on a fluor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProcathepsin L(Rattus norvegicus)
Novartis

LigandPNGBDBM25135(2-cyano-pyrropyrimidine, 7a | 7-(2-cyclohexylethyl...)
Affinity DataIC50: >1.00E+4nMAssay Description:The substrate hydrolysis with or without inhibitor was monitored at an excitation wavelength of 360nm and an emission wavelength of 460 nm on a fluor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin K(Rattus norvegicus)
Novartis

LigandPNGBDBM25135(2-cyano-pyrropyrimidine, 7a | 7-(2-cyclohexylethyl...)
Affinity DataIC50: >1.00E+4nMpH: 7.0 T: 2°CAssay Description:The substrate hydrolysis with or without inhibitor was monitored at an excitation wavelength of 360nm and an emission wavelength of 460 nm on a fluor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProcathepsin L(Homo sapiens (Human))
Novartis

LigandPNGBDBM25135(2-cyano-pyrropyrimidine, 7a | 7-(2-cyclohexylethyl...)
Affinity DataIC50:  6.80E+3nMAssay Description:The substrate hydrolysis with or without inhibitor was monitored at an excitation wavelength of 360nm and an emission wavelength of 460 nm on a fluor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin K(Homo sapiens (Human))
Novartis

LigandPNGBDBM25135(2-cyano-pyrropyrimidine, 7a | 7-(2-cyclohexylethyl...)
Affinity DataIC50:  5.90E+3nMpH: 7.0 T: 2°CAssay Description:The substrate hydrolysis with or without inhibitor was monitored at an excitation wavelength of 360nm and an emission wavelength of 460 nm on a fluor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed