BDBM36963 MLS000042482::N-[2-(3-bromanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]butanamide::N-[2-(3-bromo-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]butyramide::N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]butanamide::SMR000048709::cid_667358

SMILES CCCC(=O)Nc1ccc2oc(nc2c1)-c1ccc(OC)c(Br)c1

InChI Key InChIKey=PNPCILXOXHPNBW-UHFFFAOYSA-N

Data  3 EC50

  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 3 hits for monomerid = 36963   

TargetSphingosine 1-phosphate receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 36963BDBM36963(cid_667358 | N-[2-(3-bromanyl-4-methoxy-phenyl)-1,...)
Affinity DataEC50:  4.14E+3nMAssay 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 36963BDBM36963(cid_667358 | N-[2-(3-bromanyl-4-methoxy-phenyl)-1,...)
Affinity DataEC50:  4.96E+3nMAssay 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 36963BDBM36963(cid_667358 | N-[2-(3-bromanyl-4-methoxy-phenyl)-1,...)
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