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SMILES: [O-][n+]1ccc(cc1)-c1noc(CCC2(CCCCC2)c2ccccc2)n1

InChI Key: InChIKey=VNDSGDBONNGTAJ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 192136   
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))		BDBM192136
PNG
(US9187437, 34)
Show SMILES [O-][n+]1ccc(cc1)-c1noc(CCC2(CCCCC2)c2ccccc2)n1
Show InChI InChI=1S/C21H23N3O2/c25-24-15-10-17(11-16-24)20-22-19(26-23-20)9-14-21(12-5-2-6-13-21)18-7-3-1-4-8-18/h1,3-4,7-8,10-11,15-16H,2,5-6,9,12-14H2
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Similars
US Patent
n/an/a 67n/an/an/an/a7.525



BRISTOL-MYERS SQUIBB COMPANY

US Patent


Assay Description
Membranes were prepared from CHO cells expressing human S1P1. Cells pellets (1x108 cells/pellet) were suspended in buffer containing 20 mM HEPES, pH ...

US Patent US9187437 (2015)


BindingDB Entry DOI: 10.7270/Q2JH3K0X
More data for this
Ligand-Target Pair