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SMILES: CCc1ccc(cc1S(C)(=O)=O)-c1nc(no1)-c1ccc2N(CCc2c1)C(=O)CCC(O)=O

InChI Key: InChIKey=YFVCFIYWQTVLIC-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50357801   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))		BDBM50357801
PNG
(CHEMBL1916578)
Show SMILES CCc1ccc(cc1S(C)(=O)=O)-c1nc(no1)-c1ccc2N(CCc2c1)C(=O)CCC(O)=O
Show InChI InChI=1S/C23H23N3O6S/c1-3-14-4-5-17(13-19(14)33(2,30)31)23-24-22(25-32-23)16-6-7-18-15(12-16)10-11-26(18)20(27)8-9-21(28)29/h4-7,12-13H,3,8-11H2,1-2H3,(H,28,29)
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n/an/an/an/a 38n/an/an/an/a



Arena Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human S1P1 receptor expressed in HEK293 cells assessed as inhibition of forskolin-stimulated cAMP production after 1 hr by HTRF a...

Bioorg Med Chem Lett 21: 6013-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.110
BindingDB Entry DOI: 10.7270/Q24T6JSB
More data for this
Ligand-Target Pair