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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.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Sphingosine 1-phosphate receptor 4
Species	Homo sapiens (Human)
Gene	S1PR4
Synonym	S1P4 receptor S1P4 S1P receptor Edg-6 S1P receptor 4 endothelial differentiation, G protein-coupled receptor 6 Endothelial differentiation G-protein coupled receptor 6 edg6 Sphingosine 1-phosphate receptor Edg-6 [ Show all ]
Disease	N/A
Length	384
Amino acid sequence	MNATGTPVAPESCQQLAAGGHSRLIVLHYNHSGRLAGRGGPEDGGLGALRGLSVAASCLVVLENLLVLAAITSHMRSRRWVYYCLVNITLSDLLTGAAYLANVLLSGARTFRLAPAQWFLREGLLFTALAASTFSLLFTAGERFATMVRPVAESGATKTSRVYGFIGLCWLLAALLGMLPLLGWNCLCAFDRCSSLLPLYSKRYILFCLVIFAGVLATIMGLYGAIFRLVQASGQKAPRPAARRKARRLLKTVLMILLAFLVCWGPLFGLLLADVFGSNLWAQEYLRGMDWILALAVLNSAVNPIIYSFRSREVCRAVLSFLCCGCLRLGMRGPGDCLARAVEAHSGASTTDSSLRPRDSFRGSRSLSFRMREPLSSISSVRSI
UniProt	O95977
Protein Data Bank	N/A
GPCR-HGmod model	O95977
3D structure model	This predicted structure model is from GPCR-EXP O95977.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3230
IUPHAR	278
DrugBank	N/A

Ligand

Name	CYM50199
Molecular formula	C14H12BrCl2NO2
IUPAC name	2-bromo-3-[2-(2,4-dichlorophenoxy)ethoxy]-6-methylpyridine
Molecular weight	377.059
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	5.2
Synonyms	CHEMBL1722064 3-[2-[2,4-bis(chloranyl)phenoxy]ethoxy]-2-bromanyl-6-methyl-pyridine MLS003115020 SR-02000000306-1 CHEBI:92299 2-bromo-3-[2-(2,4-dichlorophenoxy)ethoxy]-6-methyl-pyridine cid_44620895 SMR001828628 2-bromo-3-[2-(2,4-dichlorophenoxy)ethoxy]-6-methylpyridine BDBM75604 SR-02000000306 [ Show all ]
Inchi Key	AGOUWTBVEAKQIJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H12BrCl2NO2/c1-9-2-4-13(14(15)18-9)20-7-6-19-12-5-3-10(16)8-11(12)17/h2-5,8H,6-7H2,1H3
PubChem CID	44620895
ChEMBL	CHEMBL1722064
IUPHAR	N/A
BindingDB	75604
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
EC50	52.0 nM	, PMID22119461, PubChem BioAssay data set	BindingDB,ChEMBL

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