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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	Sphingosine 1-phosphate receptor 5
Species	Homo sapiens (Human)
Gene	S1PR5
Synonym	Sphingosine 1-phosphate receptor Edg-8 S1P5 S1P receptor Edg-8 S1P5 receptor S1P receptor 5 NRG-1 nerve growth factor-regulated G-protein-coupled receptor 1 Endothelial differentiation G-protein-coupled receptor 8 endothelial differentiation G protein-coupled receptor 8 edg8 [ Show all ]
Disease	Multiple scierosis
Length	398
Amino acid sequence	MESGLLRPAPVSEVIVLHYNYTGKLRGARYQPGAGLRADAVVCLAVCAFIVLENLAVLLVLGRHPRFHAPMFLLLGSLTLSDLLAGAAYAANILLSGPLTLKLSPALWFAREGGVFVALTASVLSLLAIALERSLTMARRGPAPVSSRGRTLAMAAAAWGVSLLLGLLPALGWNCLGRLDACSTVLPLYAKAYVLFCVLAFVGILAAICALYARIYCQVRANARRLPARPGTAGTTSTRARRKPRSLALLRTLSVVLLAFVACWGPLFLLLLLDVACPARTCPVLLQADPFLGLAMANSLLNPIIYTLTNRDLRHALLRLVCCGRHSCGRDPSGSQQSASAAEASGGLRRCLPPGLDGSFSGSERSSPQRDGLDTSGSTGSPGAPTAARTLVSEPAAD
UniProt	Q9H228
Protein Data Bank	N/A
GPCR-HGmod model	Q9H228
3D structure model	This predicted structure model is from GPCR-EXP Q9H228.
BioLiP	N/A
Therapeutic Target Database	T50089
ChEMBL	CHEMBL2274
IUPHAR	279
DrugBank	BE0002432

Ligand

Name	CHEMBL334038
Molecular formula	C19H33N2O5P
IUPAC name	[(2R)-2-amino-3-(4-decylanilino)-3-oxopropyl] dihydrogen phosphate
Molecular weight	400.456
Hydrogen bond acceptor	6
Hydrogen bond donor	4
XlogP	1.3
Synonyms	Phosphoric acid mono-[(R)-2-amino-2-(4-decyl-phenylcarbamoyl)-ethyl] ester; TFA BDBM50133417 N-(4-Decylphenyl)-O-phosphono-D-serinamide CHEMBL1184130
Inchi Key	APIDPHFNNKWFKH-GOSISDBHSA-N
Inchi ID	InChI=1S/C19H33N2O5P/c1-2-3-4-5-6-7-8-9-10-16-11-13-17(14-12-16)21-19(22)18(20)15-26-27(23,24)25/h11-14,18H,2-10,15,20H2,1H3,(H,21,22)(H2,23,24,25)/t18-/m1/s1
PubChem CID	10023913
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50133417
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	41.0 nM	PMID14505636	BindingDB

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