BDBM36908 2-methoxy-4-(5-piperidin-1-ylpenta-1,3-diynyl)phenol;hydrochloride::2-methoxy-4-(5-piperidinopenta-1,3-diynyl)phenol;hydrochloride::2-methoxy-4-[5-(1-piperidinyl)penta-1,3-diynyl]phenol;hydrochloride::MLS000078799::SMR000057989::cid_2852203

SMILES COc1cc(ccc1O)C#CC#CCN1CCCCC1

InChI Key InChIKey=LPKUMYWUEQDFFQ-UHFFFAOYSA-N

Data  1 IC50  3 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 4 hits for monomerid = 36908   

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

Curated by PubChem BioAssay
LigandPNGBDBM36908(2-methoxy-4-(5-piperidin-1-ylpenta-1,3-diynyl)phen...)
Affinity DataEC50:  7.10E+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 DepthDetails PCBioAssay
TargetLarge T antigen(Simian virus 40)
Southern Research Specialized Biocontainment Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36908(2-methoxy-4-(5-piperidin-1-ylpenta-1,3-diynyl)phen...)
Affinity DataIC50:  1.03E+4nMAssay Description:A biochemical assay using the ADP-Hunter methodology, purified TAg, and ATP to identify compounds that inhibit the ATPase activity of Tag Southern Re...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36908(2-methoxy-4-(5-piperidin-1-ylpenta-1,3-diynyl)phen...)
Affinity DataEC50:  8.34E+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 DepthDetails PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36908(2-methoxy-4-(5-piperidin-1-ylpenta-1,3-diynyl)phen...)
Affinity DataEC50:  6.39E+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 DepthDetails PCBioAssay