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GPCR

NameLysophosphatidic acid receptor 3
SpeciesHomo sapiens (Human)
GeneLPAR3
SynonymLPA-3
Edg7
endothelial differentiation gene 7, lysophosphatidic acid G-protein-coupled receptor 7
LPA receptor 3
Lysophosphatidic acid receptor Edg-7
[ Show all ]
DiseaseFibrosis
Length353
Amino acid sequenceMNECHYDKHMDFFYNRSNTDTVDDWTGTKLVIVLCVGTFFCLFIFFSNSLVIAAVIKNRKFHFPFYYLLANLAAADFFAGIAYVFLMFNTGPVSKTLTVNRWFLRQGLLDSSLTASLTNLLVIAVERHMSIMRMRVHSNLTKKRVTLLILLVWAIAIFMGAVPTLGWNCLCNISACSSLAPIYSRSYLVFWTVSNLMAFLIMVVVYLRIYVYVKRKTNVLSPHTSGSISRRRTPMKLMKTVMTVLGAFVVCWTPGLVVLLLDGLNCRQCGVQHVKRWFLLLALLNSVVNPIIYSYKDEDMYGTMKKMICCFSQENPERRPSRIPSTVLSRSDTGSQYIEDSISQGAVCNKSTS
UniProtQ9UBY5
Protein Data BankN/A
GPCR-HGmod modelQ9UBY5
3D structure modelThis predicted structure model is from GPCR-EXP Q9UBY5.
BioLiPN/A
Therapeutic Target DatabaseT95923
ChEMBLCHEMBL3250
IUPHAR274
DrugBankN/A

Ligand

NameCHEMBL441066
Molecular formulaC32H50NO6P
IUPAC name[2-(hexadecanoylamino)-3-(4-phenylmethoxyphenyl)propyl] dihydrogen phosphate
Molecular weight575.727
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP8.6
SynonymsBDBM50146235
Phosphoric acid mono-[3-(4-benzyloxy-phenyl)-2-hexadecanoylamino-propyl] ester
Inchi KeyITPYKLVUHMGBBT-UHFFFAOYSA-N
Inchi IDInChI=1S/C32H50NO6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-20-32(34)33-30(27-39-40(35,36)37)25-28-21-23-31(24-22-28)38-26-29-18-15-14-16-19-29/h14-16,18-19,21-24,30H,2-13,17,20,25-27H2,1H3,(H,33,34)(H2,35,36,37)
PubChem CID44325421
ChEMBLCHEMBL441066
IUPHARN/A
BindingDB50146235
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
IC506840.0 nMPMID15125924BindingDB,ChEMBL

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