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GPCR

NameSphingosine 1-phosphate receptor 4
SpeciesHomo sapiens (Human)
GeneS1PR4
SynonymS1P4 receptor
S1P4
S1P receptor Edg-6
S1P receptor 4
endothelial differentiation, G protein-coupled receptor 6
[ Show all ]
DiseaseN/A
Length384
Amino acid sequenceMNATGTPVAPESCQQLAAGGHSRLIVLHYNHSGRLAGRGGPEDGGLGALRGLSVAASCLVVLENLLVLAAITSHMRSRRWVYYCLVNITLSDLLTGAAYLANVLLSGARTFRLAPAQWFLREGLLFTALAASTFSLLFTAGERFATMVRPVAESGATKTSRVYGFIGLCWLLAALLGMLPLLGWNCLCAFDRCSSLLPLYSKRYILFCLVIFAGVLATIMGLYGAIFRLVQASGQKAPRPAARRKARRLLKTVLMILLAFLVCWGPLFGLLLADVFGSNLWAQEYLRGMDWILALAVLNSAVNPIIYSFRSREVCRAVLSFLCCGCLRLGMRGPGDCLARAVEAHSGASTTDSSLRPRDSFRGSRSLSFRMREPLSSISSVRSI
UniProtO95977
Protein Data BankN/A
GPCR-HGmod modelO95977
3D structure modelThis predicted structure model is from GPCR-EXP O95977.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3230
IUPHAR278
DrugBankN/A

Ligand

NameCYM50199
Molecular formulaC14H12BrCl2NO2
IUPAC name2-bromo-3-[2-(2,4-dichlorophenoxy)ethoxy]-6-methylpyridine
Molecular weight377.059
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP5.2
Synonyms2-bromo-3-[2-(2,4-dichlorophenoxy)ethoxy]-6-methyl-pyridine
cid_44620895
SMR001828628
2-bromo-3-[2-(2,4-dichlorophenoxy)ethoxy]-6-methylpyridine
SR-02000000306
[ Show all ]
Inchi KeyAGOUWTBVEAKQIJ-UHFFFAOYSA-N
Inchi IDInChI=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 CID44620895
ChEMBLCHEMBL1722064
IUPHARN/A
BindingDB75604
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
EC5052.0 nM, PMID22119461, PubChem BioAssay data setBindingDB,ChEMBL

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