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GPCR

NameFree fatty acid receptor 1
SpeciesHomo sapiens (Human)
GeneFFAR1
SynonymFFA1R
G protein-coupled receptor 40
G-protein coupled receptor 40
GPR40
FFA1 receptor
DiseaseType 2 diabetes
Non-insulin dependent diabetes
Diabetes
Length300
Amino acid sequenceMDLPPQLSFGLYVAAFALGFPLNVLAIRGATAHARLRLTPSLVYALNLGCSDLLLTVSLPLKAVEALASGAWPLPASLCPVFAVAHFFPLYAGGGFLAALSAGRYLGAAFPLGYQAFRRPCYSWGVCAAIWALVLCHLGLVFGLEAPGGWLDHSNTSLGINTPVNGSPVCLEAWDPASAGPARFSLSLLLFFLPLAITAFCYVGCLRALARSGLTHRRKLRAAWVAGGALLTLLLCVGPYNASNVASFLYPNLGGSWRKLGLITGAWSVVLNPLVTGYLGRGPGLKTVCAARTQGGKSQK
UniProtO14842
Protein Data Bank5tzy, 5tzr
GPCR-HGmod modelO14842
3D structure modelThis structure is from PDB ID 5tzy.
BioLiPBL0380462, BL0380463, BL0380464
Therapeutic Target DatabaseT25608
ChEMBLCHEMBL4422
IUPHAR225
DrugBankBE0000688

Ligand

NameCHEMBL2022245
Molecular formulaC28H30O3
IUPAC name2-[2-[[3-(2,6-dimethylphenyl)phenyl]methoxy]-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl]acetic acid
Molecular weight414.545
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP7.0
SynonymsSCHEMBL3449367
BDBM50382543
Inchi KeyAJDAZNXXSMAOOJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H30O3/c1-19-7-5-8-20(2)28(19)24-12-6-9-21(15-24)18-31-25-13-14-26-22(16-25)10-3-4-11-23(26)17-27(29)30/h5-9,12-16,23H,3-4,10-11,17-18H2,1-2H3,(H,29,30)
PubChem CID23111754
ChEMBLCHEMBL2022245
IUPHARN/A
BindingDB50382543
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC50540.0 nMPMID24900210BindingDB,ChEMBL
EC50940.0 nMPMID22242551BindingDB,ChEMBL
Ki2400.0 nMPMID24900210, PMID22242551BindingDB,ChEMBL

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