BDBM36893 4-[3-(1-benzotriazolyl)-2-hydroxypropoxy]benzoic acid methyl ester::4-[3-(benzotriazol-1-yl)-2-hydroxy-propoxy]benzoic acid methyl ester::MLS000079871::SMR000040056::cid_659056::methyl 4-[3-(benzotriazol-1-yl)-2-hydroxypropoxy]benzoate::methyl 4-[3-(benzotriazol-1-yl)-2-oxidanyl-propoxy]benzoate

SMILES COC(=O)c1ccc(OCC(O)Cn2nnc3ccccc23)cc1

InChI Key InChIKey=QAKDRADLKGEDJG-UHFFFAOYSA-N

Data  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 3 hits for monomerid = 36893   

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

Curated by PubChem BioAssay
LigandPNGBDBM36893(4-[3-(1-benzotriazolyl)-2-hydroxypropoxy]benzoic a...)
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 DepthDetails PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36893(4-[3-(1-benzotriazolyl)-2-hydroxypropoxy]benzoic a...)
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 DepthDetails PCBioAssay
TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM36893(4-[3-(1-benzotriazolyl)-2-hydroxypropoxy]benzoic a...)
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 DepthDetails PCBioAssay