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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Free fatty acid receptor 4
Species	Homo sapiens (Human)
Gene	FFAR4
Synonym	PGR4 Omega-3 fatty acid receptor 1 O3FAR1 GT01 GPR129 GPR120 G-protein-coupled receptor GT01 G-protein coupled receptor PGR4 FFA4 receptor G-protein coupled receptor 129 G-protein coupled receptor 120 G protein-coupled receptor 129 G protein-coupled receptor 120 G-protein coupled receptor GT01 [ Show all ]
Disease	N/A
Length	377
Amino acid sequence	MSPECARAAGDAPLRSLEQANRTRFPFFSDVKGDHRLVLAAVETTVLVLIFAVSLLGNVCALVLVARRRRRGATACLVLNLFCADLLFISAIPLVLAVRWTEAWLLGPVACHLLFYVMTLSGSVTILTLAAVSLERMVCIVHLQRGVRGPGRRARAVLLALIWGYSAVAALPLCVFFRVVPQRLPGADQEISICTLIWPTIPGEISWDVSFVTLNFLVPGLVIVISYSKILQTSEHLLDARAVVTHSEITKASRKRLTVSLAYSESHQIRVSQQDFRLFRTLFLLMVSFFIMWSPIIITILLILIQNFKQDLVIWPSLFFWVVAFTFANSALNPILYNMTLCRNEWKKIFCCFWFPEKGAILTDTSVKRNDLSIISG
UniProt	Q5NUL3
Protein Data Bank	N/A
GPCR-HGmod model	Q5NUL3
3D structure model	This predicted structure model is from GPCR-EXP Q5NUL3.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL5339
IUPHAR	127
DrugBank	BE0003399

Ligand

Name	CHEMBL3900705
Molecular formula	C21H22FNO4
IUPAC name	3-[(2R)-6-(5-cyclobutyloxy-2-fluoropyridin-3-yl)-3,4-dihydro-2H-chromen-2-yl]propanoic acid
Molecular weight	371.408
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	4.1
Synonyms	BDBM50207068
Inchi Key	HGDFRNBNPYHIOH-MRXNPFEDSA-N
Inchi ID	InChI=1S/C21H22FNO4/c22-21-18(11-17(12-23-21)26-15-2-1-3-15)13-5-8-19-14(10-13)4-6-16(27-19)7-9-20(24)25/h5,8,10-12,15-16H,1-4,6-7,9H2,(H,24,25)/t16-/m1/s1
PubChem CID	134133992
ChEMBL	CHEMBL3900705
IUPHAR	N/A
BindingDB	50207068
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Activity	<50.0 %	PMID28105282	ChEMBL
EC50	79.0 nM	PMID28105282	BindingDB,ChEMBL
EC50	140.0 nM	PMID28105282	BindingDB,ChEMBL

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