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SMILES: COc1ccc(F)cc1-c1noc(n1)-c1ccc(N2CCCCC2C)c(c1)N([O-])=O

InChI Key: InChIKey=SQOUNMXXXIECGQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 139202   
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))		BDBM139202
PNG
(US8889668, I32)
Show SMILES COc1ccc(F)cc1-c1noc(n1)-c1ccc(N2CCCCC2C)c(c1)N([O-])=O
Show InChI InChI=1S/C21H21FN4O4/c1-13-5-3-4-10-25(13)17-8-6-14(11-18(17)26(27)28)21-23-20(24-30-21)16-12-15(22)7-9-19(16)29-2/h6-9,11-13H,3-5,10H2,1-2H3/q-1
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Similars
US Patent
 1 -11.4n/an/an/an/an/a7.44



Merck Serono SA

US Patent


Assay Description
Receptor binding assay: Membranes were prepared from CHO cells expressing S1P1 or S1P3 for use in ligand and 35S-GTPgammaS binding studies. Cells wer...

US Patent US8889668 (2014)


BindingDB Entry DOI: 10.7270/Q2V123G0
More data for this
Ligand-Target Pair