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Compile Data Set for Download or QSAR

Found 1 hit of ec50 for monomerid = 50114062   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/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))		BDBM50114062
PNG
(CHEMBL3605532)
Show SMILES CCn1c(nc2ccc(cc12)C(F)(F)F)[C@@H](C)NS(=O)(=O)c1ccccc1 |r|
Show InChI InChI=1S/C18H18F3N3O2S/c1-3-24-16-11-13(18(19,20)21)9-10-15(16)22-17(24)12(2)23-27(25,26)14-7-5-4-6-8-14/h4-12,23H,3H2,1-2H3/t12-/m1/s1
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Article
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n/an/an/an/a 8n/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Antagonist activity against human S1P1 receptor expressed in human U2OS cells co-expressing GFP assessed as inhibition of S1P-induced receptor transl...

J Med Chem 58: 7057-75 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01078
BindingDB Entry DOI: 10.7270/Q2Z89F6J
More data for this
Ligand-Target Pair