BDBM16763 3-N-[(2S,3S,5R)-1-(3,5-difluorophenyl)-5-{[(1R,3R,5S)-3,5-dimethoxycyclohexyl]carbamoyl}-5-ethyl-3-hydroxypentan-2-yl]-1-N,1-N-dipropylbenzene-1,3-dicarboxamide::CHEMBL295109::Hydroxyethylene-Based Peptidomimetic Inhibitor, 13

SMILES CCCN(CCC)C(=O)c1cccc(c1)C(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@@H](O)C[C@@H](CC)C(=O)N[C@@H]1C[C@@H](C[C@@H](C1)OC)OC

InChI Key InChIKey=PELCHZGPMNNYHX-HMHRWXBJSA-N

Data  2 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 2 hits for monomerid = 16763   

TargetBeta-secretase 1(Homo sapiens (Human))
Johnson & Johnson Pharmaceutical Research And Development

Curated by ChEMBL
LigandPNGBDBM16763(3-N-[(2S,3S,5R)-1-(3,5-difluorophenyl)-5-{[(1R,3R,...)
Affinity DataIC50:  6.60E+3nMAssay Description:Binding affinity against Beta-secretaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-secretase 1(Homo sapiens (Human))
Johnson & Johnson Pharmaceutical Research And Development

Curated by ChEMBL
LigandPNGBDBM16763(3-N-[(2S,3S,5R)-1-(3,5-difluorophenyl)-5-{[(1R,3R,...)
Affinity DataIC50:  6.60E+3nMpH: 4.8 T: 2°CAssay Description:Beta-cleavage ELISA assays were carried out in reaction buffer containing enzyme, substrate MBP-C125, and test compounds. Generated beta-cleaved prod...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed