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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 1
Species	Homo sapiens (Human)
Gene	FFAR1
Synonym	FFA1R G protein-coupled receptor 40 G-protein coupled receptor 40 GPR40 FFA1 receptor
Disease	Type 2 diabetes Non-insulin dependent diabetes Diabetes
Length	300
Amino acid sequence	MDLPPQLSFGLYVAAFALGFPLNVLAIRGATAHARLRLTPSLVYALNLGCSDLLLTVSLPLKAVEALASGAWPLPASLCPVFAVAHFFPLYAGGGFLAALSAGRYLGAAFPLGYQAFRRPCYSWGVCAAIWALVLCHLGLVFGLEAPGGWLDHSNTSLGINTPVNGSPVCLEAWDPASAGPARFSLSLLLFFLPLAITAFCYVGCLRALARSGLTHRRKLRAAWVAGGALLTLLLCVGPYNASNVASFLYPNLGGSWRKLGLITGAWSVVLNPLVTGYLGRGPGLKTVCAARTQGGKSQK
UniProt	O14842
Protein Data Bank	5tzy, 5tzr
GPCR-HGmod model	O14842
3D structure model	This structure is from PDB ID 5tzy.
BioLiP	BL0380462, BL0380463, BL0380464
Therapeutic Target Database	T25608
ChEMBL	CHEMBL4422
IUPHAR	225
DrugBank	BE0000688

Ligand

Name	DC260126
Molecular formula	C16H18FNO2S
IUPAC name	N-(4-butylphenyl)-4-fluorobenzenesulfonamide
Molecular weight	307.383
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.4
Synonyms	AOB4592 HY-101906 ST45139400 N-(4-butylphenyl)-4-fluoro-1-benzenesulfonamide ZINC2497192 346692-04-4 AK688901 DC 260126 Oprea1_825888 AS-16530 MCULE-1264747468 STK076838 CHEMBL3931570 N-(4-butylphenyl)-4-fluorobenzenesulfonamide AKOS003265834 SCHEMBL18058899 BDBM50196405 MolPort-001-507-368 SYN5170 (4-butylphenyl)[(4-fluorophenyl)sulfonyl]amine CS-7709 NCGC00387268-04 AC1MDUI6 [ Show all ]
Inchi Key	CNGHPXKWPGIDSK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H18FNO2S/c1-2-3-4-13-5-9-15(10-6-13)18-21(19,20)16-11-7-14(17)8-12-16/h5-12,18H,2-4H2,1H3
PubChem CID	2843133
ChEMBL	CHEMBL3931570
IUPHAR	N/A
BindingDB	50196405
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
IC50	8128.0 nM	PMID27570890	BindingDB
IC50	8128.31 nM	PMID27570890	ChEMBL
Imax	68.0 %	PMID27570890	ChEMBL

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