BDBM129604 US8802663, 145

SMILES COCc1c(cnn1C1CCCCC1)-c1nc(no1)-c1cccc(CCC(O)=O)c1

InChI Key InChIKey=BUWHIJJAYBBSCR-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 129604   

TargetSphingosine 1-phosphate receptor 1(Human)
Merck Serono

US Patent
LigandPNGBDBM129604(US8802663, 145)
Affinity DataKi:  116nM ΔG°:  -8.79kcal/molepH: 7.4 T: 2°CAssay Description:Receptor binding assay: Membranes were prepared from CHO cells expressing S1P1 or S1P3 for use in ligand and 355-GTPgammaS binding studies. Cells wer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/19/2015
Entry Details
US Patent