BDBM37160 (E)-N,N-dimethyl-2-[3-methyl-4-(4-phenylpiperazin-1-yl)sulfonyl-1,2-oxazol-5-yl]ethenamine::(E)-N,N-dimethyl-2-[3-methyl-4-[(4-phenyl-1-piperazinyl)sulfonyl]-5-isoxazolyl]ethenamine::MLS000120314::SMR000097230::cid_5307865::dimethyl-[(E)-2-[3-methyl-4-(4-phenylpiperazino)sulfonyl-isoxazol-5-yl]vinyl]amine

SMILES CN(C)\C=C\c1onc(C)c1S(=O)(=O)N1CCN(CC1)c1ccccc1

InChI Key InChIKey=GKHJQSMCPZTCKJ-UHFFFAOYSA-N

Data  2 IC50  3 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 37160   

TargetProcathepsin L(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37160BDBM37160(cid_5307865 | SMR000097230 | (E)-N,N-dimethyl-2-[3...)
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:
5/28/2011
Entry Details
PCBioAssay
TargetProcathepsin L(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37160BDBM37160(cid_5307865 | SMR000097230 | (E)-N,N-dimethyl-2-[3...)
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:
5/11/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37160BDBM37160(cid_5307865 | SMR000097230 | (E)-N,N-dimethyl-2-[3...)
Affinity DataEC50: >9.50E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37160BDBM37160(cid_5307865 | SMR000097230 | (E)-N,N-dimethyl-2-[3...)
Affinity DataEC50: >9.50E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2011
Entry Details
PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 37160BDBM37160(cid_5307865 | SMR000097230 | (E)-N,N-dimethyl-2-[3...)
Affinity DataEC50: >9.51E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/28/2011
Entry Details
PCBioAssay