BDBM59778 3,4-Dimethyl-6-phenethylcarbamoyl-cyclohex-3-enecarboxylic acid::3,4-dimethyl-6-(2-phenylethylcarbamoyl)cyclohex-3-ene-1-carboxylic acid::3,4-dimethyl-6-(phenethylcarbamoyl)cyclohex-3-ene-1-carboxylic acid::3,4-dimethyl-6-[oxo-(2-phenylethylamino)methyl]-1-cyclohex-3-enecarboxylic acid::MLS000523308::SMR000123286::cid_2891105

SMILES CC1=C(C)CC(C(C1)C(O)=O)C(=O)NCCc1ccccc1

InChI Key InChIKey=JSSJOPLRIITHQE-UHFFFAOYSA-N

Data  3 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 5 hits for monomerid = 59778   

TargetTrace amine-associated receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM59778(MLS000523308 | cid_2891105 | 3,4-dimethyl-6-[oxo-(...)
Affinity DataEC50:  1.40E+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
LigandPNGBDBM59778(MLS000523308 | cid_2891105 | 3,4-dimethyl-6-[oxo-(...)
Affinity DataIC50: 7.20E+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
LigandPNGBDBM59778(MLS000523308 | cid_2891105 | 3,4-dimethyl-6-[oxo-(...)
Affinity DataIC50: 2.99E+4nMMore 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
LigandPNGBDBM59778(MLS000523308 | cid_2891105 | 3,4-dimethyl-6-[oxo-(...)
Affinity DataEC50: >2.99E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetM17 leucyl aminopeptidase(Plasmodium falciparum (isolate 3D7))
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM59778(MLS000523308 | cid_2891105 | 3,4-dimethyl-6-[oxo-(...)
Affinity DataIC50: 4.60E+4nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/8/2011
Entry Details
PCBioAssay