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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 2
Species	Homo sapiens (Human)
Gene	S1PR2
Synonym	Endothelial differentiation G-protein coupled receptor 5 Sphingosine 1-phosphate receptor Edg-5 S1P2 receptor S1P2 S1P receptor Edg-5 S1P receptor 2 edg5 endothelial differentiation G protein-coupled receptor 5 GPCR18 Gpcr13 G protein-coupled receptor 13 [ Show all ]
Disease	Hypertension
Length	353
Amino acid sequence	MGSLYSEYLNPNKVQEHYNYTKETLETQETTSRQVASAFIVILCCAIVVENLLVLIAVARNSKFHSAMYLFLGNLAASDLLAGVAFVANTLLSGSVTLRLTPVQWFAREGSAFITLSASVFSLLAIAIERHVAIAKVKLYGSDKSCRMLLLIGASWLISLVLGGLPILGWNCLGHLEACSTVLPLYAKHYVLCVVTIFSIILLAIVALYVRIYCVVRSSHADMAAPQTLALLKTVTIVLGVFIVCWLPAFSILLLDYACPVHSCPILYKAHYFFAVSTLNSLLNPVIYTWRSRDLRREVLRPLQCWRPGVGVQGRRRGGTPGHHLLPLRSSSSLERGMHMPTSPTFLEGNTVV
UniProt	O95136
Protein Data Bank	N/A
GPCR-HGmod model	O95136
3D structure model	This predicted structure model is from GPCR-EXP O95136.
BioLiP	N/A
Therapeutic Target Database	T47888
ChEMBL	CHEMBL2955
IUPHAR	276
DrugBank	N/A

Ligand

Name	CHEMBL332373
Molecular formula	C18H32NO4P
IUPAC name	3-[(4-octoxyphenyl)methylamino]propylphosphonic acid
Molecular weight	357.431
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	0.9
Synonyms	[3-(4-Octyloxy-benzylamino)-propyl]-phosphonic acid BDBM50148437 SCHEMBL14195599
Inchi Key	BDZJQGMIIWGSHK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H32NO4P/c1-2-3-4-5-6-7-14-23-18-11-9-17(10-12-18)16-19-13-8-15-24(20,21)22/h9-12,19H,2-8,13-16H2,1H3,(H2,20,21,22)
PubChem CID	10172354
ChEMBL	CHEMBL332373
IUPHAR	N/A
BindingDB	50148437
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	6.3 nM	PMID15177461	BindingDB,ChEMBL
IC50	4600.0 nM	PMID15177461	BindingDB,ChEMBL

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