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GPCR

NameFree fatty acid receptor 4
SpeciesHomo sapiens (Human)
GeneFFAR4
SynonymPGR4
Omega-3 fatty acid receptor 1
O3FAR1
GT01
GPR129
[ Show all ]
DiseaseN/A
Length377
Amino acid sequenceMSPECARAAGDAPLRSLEQANRTRFPFFSDVKGDHRLVLAAVETTVLVLIFAVSLLGNVCALVLVARRRRRGATACLVLNLFCADLLFISAIPLVLAVRWTEAWLLGPVACHLLFYVMTLSGSVTILTLAAVSLERMVCIVHLQRGVRGPGRRARAVLLALIWGYSAVAALPLCVFFRVVPQRLPGADQEISICTLIWPTIPGEISWDVSFVTLNFLVPGLVIVISYSKILQTSEHLLDARAVVTHSEITKASRKRLTVSLAYSESHQIRVSQQDFRLFRTLFLLMVSFFIMWSPIIITILLILIQNFKQDLVIWPSLFFWVVAFTFANSALNPILYNMTLCRNEWKKIFCCFWFPEKGAILTDTSVKRNDLSIISG
UniProtQ5NUL3
Protein Data BankN/A
GPCR-HGmod modelQ5NUL3
3D structure modelThis predicted structure model is from GPCR-EXP Q5NUL3.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5339
IUPHAR127
DrugBankBE0003399

Ligand

NameTUG-424
Molecular formulaC18H16O2
IUPAC name3-[4-[2-(2-methylphenyl)ethynyl]phenyl]propanoic acid
Molecular weight264.324
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP4.1
Synonyms3-{4-[2-(2-methylphenyl)ethynyl]phenyl}propanoic acid
BDBM50275597
J-002071
TUG 424
4-[2-(2-methylphenyl)ethynyl]-benzenepropanoic acid
[ Show all ]
Inchi KeyFODHWOBAQBTTFS-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H16O2/c1-14-4-2-3-5-17(14)12-10-15-6-8-16(9-7-15)11-13-18(19)20/h2-9H,11,13H2,1H3,(H,19,20)
PubChem CID25150014
ChEMBLCHEMBL449588
IUPHAR3952
BindingDB50275597
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
EC501445.0 nMPMID23687558BindingDB
EC501445.44 nMPMID23687558ChEMBL
EC502238.72 nMPMID22519963BindingDB,ChEMBL
Efficacy100.0 %PMID22519963ChEMBL
Efficacy103.0 %PMID23687558ChEMBL

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