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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

NameSCHEMBL17418721
Molecular formulaC33H39FN2O6
IUPAC name(3S)-3-cyclopropyl-3-[3-[[5-(2-fluoro-5-methoxyphenyl)-6-(2,2,6,6-tetramethyloxan-4-yl)oxypyrazin-2-yl]methoxy]phenyl]propanoic acid
Molecular weight578.681
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP5.6
Synonyms(3S)-3-Cyclopropyl-3-(3-((5-(2-fluoro-5-methoxyphenyl)-6-(2,2,6,6-tetramethyl-tetrahydro-2H-pyran-4-yloxy)pyrazin-2-yl)methoxy)phenyl)propanoic acid
MRBDSBIVJCROCF-SANMLTNESA-N
BDBM168165
US9688642, 26
Inchi KeyMRBDSBIVJCROCF-SANMLTNESA-N
Inchi IDInChI=1S/C33H39FN2O6/c1-32(2)16-25(17-33(3,4)42-32)41-31-30(27-14-23(39-5)11-12-28(27)34)35-18-22(36-31)19-40-24-8-6-7-21(13-24)26(15-29(37)38)20-9-10-20/h6-8,11-14,18,20,25-26H,9-10,15-17,19H2,1-5H3,(H,37,38)/t26-/m0/s1
PubChem CID118645505
ChEMBLN/A
IUPHARN/A
BindingDB168165
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
EC5021.0 nMN/ABindingDB

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