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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	Free fatty acid receptor 2
Species	Homo sapiens (Human)
Gene	FFAR2
Synonym	FFA2R G protein-coupled receptor 43 G-protein coupled receptor 43 GPCR3 GPR43 FFA2 receptor [ Show all ]
Disease	Abortion Diabetes
Length	330
Amino acid sequence	MLPDWKSSLILMAYIIIFLTGLPANLLALRAFVGRIRQPQPAPVHILLLSLTLADLLLLLLLPFKIIEAASNFRWYLPKVVCALTSFGFYSSIYCSTWLLAGISIERYLGVAFPVQYKLSRRPLYGVIAALVAWVMSFGHCTIVIIVQYLNTTEQVRSGNEITCYENFTDNQLDVVLPVRLELCLVLFFIPMAVTIFCYWRFVWIMLSQPLVGAQRRRRAVGLAVVTLLNFLVCFGPYNVSHLVGYHQRKSPWWRSIAVVFSSLNASLDPLLFYFSSSVVRRAFGRGLQVLRNQGSSLLGRRGKDTAEGTNEDRGVGQGEGMPSSDFTTE
UniProt	O15552
Protein Data Bank	N/A
GPCR-HGmod model	O15552
3D structure model	This predicted structure model is from GPCR-EXP O15552.
BioLiP	N/A
Therapeutic Target Database	T28213
ChEMBL	CHEMBL5493
IUPHAR	226
DrugBank	N/A

Ligand

Name	CHEMBL594524
Molecular formula	C15H17ClN2OS
IUPAC name	(2S)-2-(4-chlorophenyl)-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)butanamide
Molecular weight	308.824
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	4.5
Synonyms	(S)-2-(4-chlorophenyl)-3-methyl-N-(5-methylthiazol-2-yl)butanamide BDBM50305979 ZINC3282389 (2S)-2-(4-chlorophenyl)-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)butanamide AC1M6GQV
Inchi Key	DFTNXSBJYPSRAQ-ZDUSSCGKSA-N
Inchi ID	InChI=1S/C15H17ClN2OS/c1-9(2)13(11-4-6-12(16)7-5-11)14(19)18-15-17-8-10(3)20-15/h4-9,13H,1-3H3,(H,17,18,19)/t13-/m0/s1
PubChem CID	2397905
ChEMBL	CHEMBL594524
IUPHAR	N/A
BindingDB	50305979
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Efficacy	99.0 %	PMID20005104	ChEMBL
IC50	800.0 nM	PMID20005104	BindingDB,ChEMBL

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