BDBM40389 2-(2-phenylethylcarbamoyl)cyclohexane-1-carboxylic acid::2-(phenethylcarbamoyl)cyclohexanecarboxylic acid::2-[oxo-(2-phenylethylamino)methyl]-1-cyclohexanecarboxylic acid::2-{[(2-phenylethyl)amino]carbonyl}cyclohexanecarboxylic acid::MLS000058876::SMR000069445::cid_2841922

SMILES OC(=O)C1CCCCC1C(=O)NCCc1ccccc1

InChI Key InChIKey=ZVGKSRYCAMAYDG-UHFFFAOYSA-N

Data  4 IC50  2 EC50

  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 6 hits for monomerid = 40389   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM40389(2-[oxo-(2-phenylethylamino)methyl]-1-cyclohexaneca...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/6/2011
Entry Details
PCBioAssay
TargetCathepsin S(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM40389(2-[oxo-(2-phenylethylamino)methyl]-1-cyclohexaneca...)
Affinity DataIC50: 5.00E+4nMAssay Description:Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/12/2011
Entry Details
PCBioAssay
TargetGuanine nucleotide-binding protein subunit alpha-15(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM40389(2-[oxo-(2-phenylethylamino)methyl]-1-cyclohexaneca...)
Affinity DataEC50: >2.99E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetTrace amine-associated receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM40389(2-[oxo-(2-phenylethylamino)methyl]-1-cyclohexaneca...)
Affinity DataIC50: 8.04E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetTrace amine-associated receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM40389(2-[oxo-(2-phenylethylamino)methyl]-1-cyclohexaneca...)
Affinity DataEC50:  1.43E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetGuanine nucleotide-binding protein subunit alpha-15(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM40389(2-[oxo-(2-phenylethylamino)methyl]-1-cyclohexaneca...)
Affinity DataIC50: 2.99E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay