BDBM26512 3-ethyl-N-[(2S,3R)-3-hydroxy-4-(methylamino)-1-phenylbutan-2-yl]-9-methyl-10,10-dioxo-10-thia-1,9-diazatricyclo[6.4.1.0^{4,13}]trideca-2,4(13),5,7-tetraene-6-carboxamide::BMCL193669 Compound 28::tricyclic hydroxyethylamine (HEA) derivative, 8f

SMILES CCc1cn2CCS(=O)(=O)N(C)c3cc(cc1c23)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC

InChI Key InChIKey=GXBZBNGARSSJGU-JTHBVZDNSA-N

Data  6 IC50

  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 6 hits for monomerid = 26512   

TargetBeta-secretase 1(Human)
Gsk

LigandPNGBDBM26512(3-ethyl-N-[(2S,3R)-3-hydroxy-4-(methylamino)-1-phe...)
Affinity DataIC50:  15nMpH: 4.5 T: 22°CAssay Description:Enzyme activity and inhibition were assayed using a fluorescent FAM-[SEVNLDAEFK]-TAMRA substrate. Control reactions with no enzyme were included in e...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetBeta-secretase 2(Human)
Gsk

LigandPNGBDBM26512(3-ethyl-N-[(2S,3R)-3-hydroxy-4-(methylamino)-1-phe...)
Affinity DataIC50:  1.26E+3nMpH: 4.5 T: 22°CAssay Description:Enzyme activity and inhibition were assayed using a fluorescent FAM-[SEVNLDAEFK]-TAMRA substrate. Control reactions with no enzyme were included in e...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetCathepsin D(Human)
Gsk

LigandPNGBDBM26512(3-ethyl-N-[(2S,3R)-3-hydroxy-4-(methylamino)-1-phe...)
Affinity DataIC50:  5.89E+4nMAssay Description:Enzyme activity and inhibition were assayed using a fluorescent FAM-[SEVNLDAEFK]-TAMRA substrate. Control reactions with no enzyme were included in e...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetBeta-secretase 1(Human)
Gsk

LigandPNGBDBM26512(3-ethyl-N-[(2S,3R)-3-hydroxy-4-(methylamino)-1-phe...)
Affinity DataIC50:  15nMpH: 4.5 T: 22°CAssay Description:Enzyme activity and inhibition were assayed using a fluorescent FAM-[SEVNLDAEFK]-TAMRA substrate. Control reactions with no enzyme were included in e...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetBeta-secretase 2(Human)
Gsk

LigandPNGBDBM26512(3-ethyl-N-[(2S,3R)-3-hydroxy-4-(methylamino)-1-phe...)
Affinity DataIC50:  1.26E+3nMAssay Description:Enzyme activity and inhibition were assayed using a fluorescent FAM-[SEVNLDAEFK]-TAMRA substrate. Control reactions with no enzyme were included in e...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetCathepsin D(Human)
Gsk

LigandPNGBDBM26512(3-ethyl-N-[(2S,3R)-3-hydroxy-4-(methylamino)-1-phe...)
Affinity DataIC50:  5.89E+4nMAssay Description:Enzyme activity and inhibition were assayed using a fluorescent FAM-[SEVNLDAEFK]-TAMRA substrate. Control reactions with no enzyme were included in e...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed