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Compile Data Set for Download or QSAR

Found 1 hit of ec50 for monomerid = 50136475   
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))		BDBM50136475
PNG
(CHEMBL3752350)
Show SMILES CC(C)Nc1cc(cc(C)n1)-c1nnc(s1)-c1cc(F)c(O[C@H]2CCC(=O)NC2)cc1Cl |r|
Show InChI InChI=1S/C22H23ClFN5O2S/c1-11(2)26-19-7-13(6-12(3)27-19)21-28-29-22(32-21)15-8-17(24)18(9-16(15)23)31-14-4-5-20(30)25-10-14/h6-9,11,14H,4-5,10H2,1-3H3,(H,25,30)(H,26,27)/t14-/m0/s1
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Article
PubMed
n/an/an/an/a 160n/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity at human S1P1 receptor expressed in EDG1-bla U2OS cells incubated for 18 hrs prior to GenBlazer substrate addition by beta-arrestin ...

Bioorg Med Chem Lett 26: 466-71 (2016)


Article DOI: 10.1016/j.bmcl.2015.11.090
BindingDB Entry DOI: 10.7270/Q2GX4DD4
More data for this
Ligand-Target Pair