BDBM21459 3-[(1-aminoethyl)(hydroxy)phosphoryl]-2-benzylpropanoic acid::CHEMBL51566::Phosphinic Peptide Inhibitor, 18

SMILES CC(=N)P(O)(O)CC(Cc1ccccc1)C(O)=O

InChI Key InChIKey=XNBNEBVWZQQHDN-UHFFFAOYSA-N

Data  1 KI  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 21459   

TargetAngiotensin-converting enzyme 2(Homo sapiens (Human))
University Of Athens

LigandPNGBDBM21459(3-[(1-aminoethyl)(hydroxy)phosphoryl]-2-benzylprop...)
Affinity DataKi: >1.00E+4nM ΔG°: >-6.82kcal/molepH: 6.8 T: 2°CAssay Description:Continuous assays were performed by recording the fluorescence increase at 405 nm (excitation@ 320 nm) induced by the cleavage of fluorogenic substra...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetUDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase(Staphylococcus epidermidis (strain ATCC 35984 / RP...)
Merck Sharp And Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM21459(3-[(1-aminoethyl)(hydroxy)phosphoryl]-2-benzylprop...)
Affinity DataIC50:  5.00E+4nMAssay Description:Antibacterial activity against D-alanyl-D-alanine ligase from Streptococcus faecalis (ATCC 8043)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed