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GLASS

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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	MLS000083916
Molecular formula	C24H18N2O6
IUPAC name	2-(furan-2-yl)-8-methoxy-3-[(4-methoxyphenyl)methyl]chromeno[2,3-d]pyrimidine-4,5-dione
Molecular weight	430.416
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	3.4
Synonyms	2-(furan-2-yl)-8-methoxy-3-(4-methoxybenzyl)-4H-chromeno[2,3-d]pyrimidine-4,5(3H)-dione CHEMBL1471099 STK594832 896071-91-3 MCULE-5980939235 2-(2-furanyl)-8-methoxy-3-[(4-methoxyphenyl)methyl][1]benzopyrano[2,3-d]pyrimidine-4,5-dione BDBM41645 MolPort-002-636-786 2-(furan-2-yl)-8-methoxy-3-[(4-methoxyphenyl)methyl]chromeno[2,3-d]pyrimidine-4,5-dione cid_665980 ZINC2434180 AC1LDEZW 2-(2-furyl)-8-methoxy-3-p-anisyl-chromeno[2,3-d]pyrimidine-4,5-quinone SMR000047202 HMS2364F19 AKOS005516565 MLS002584533 [ Show all ]
Inchi Key	CUMRKQQJHRKDGD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H18N2O6/c1-29-15-7-5-14(6-8-15)13-26-22(18-4-3-11-31-18)25-23-20(24(26)28)21(27)17-10-9-16(30-2)12-19(17)32-23/h3-12H,13H2,1-2H3
PubChem CID	665980
ChEMBL	CHEMBL1471099
IUPHAR	N/A
BindingDB	41645
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	<50000.0 nM	, PubChem BioAssay data set	BindingDB,ChEMBL

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