BDBM50159364 CHEMBL192441::isopropyl (2S,4R)-2-{[(2,5-difluorobenzyl)amino]methyl}-4-mercaptopyrrolidine-1-carboxylate

SMILES CC(C)OC(=O)N1C[C@H](S)CC1CNCc1cc(F)ccc1F

InChI Key InChIKey=KPTREEYKORVOGB-UHFFFAOYSA-N

Data  4 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50159364   

TargetNeprilysin(Human)
University Institute of Pathology

Curated by ChEMBL
LigandPNGBDBM50159364(isopropyl (2S,4R)-2-{[(2,5-difluorobenzyl)amino]me...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibitory concentration against NeprilysinMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetAngiotensin-converting enzyme(Human)
University Institute of Pathology

Curated by ChEMBL
LigandPNGBDBM50159364(isopropyl (2S,4R)-2-{[(2,5-difluorobenzyl)amino]me...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibitory concentration against human angiotensin I converting enzymeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetEndothelin-converting enzyme 1(Human)
University Institute of Pathology

Curated by ChEMBL
LigandPNGBDBM50159364(isopropyl (2S,4R)-2-{[(2,5-difluorobenzyl)amino]me...)
Affinity DataIC50: 16nMAssay Description:Inhibitory concentration against human ECE-1 by RIAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetEndothelin-converting enzyme 1(Human)
University Institute of Pathology

Curated by ChEMBL
LigandPNGBDBM50159364(isopropyl (2S,4R)-2-{[(2,5-difluorobenzyl)amino]me...)
Affinity DataIC50: 1.09E+3nMAssay Description:Inhibitory concentration against human ECE-1 expressed in MDCK cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed