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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	Docosahexaenoic acid
Molecular formula	C22H32O2
IUPAC name	(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoic acid
Molecular weight	328.496
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	6.2
Synonyms	AC1L9I8O Martek DHA HM all-Z-Docosahexaenoic acid NCGC00161345-03 C06429 SMR001881493 Cervonic acid\|\|\|DHA UNII-9B22238JYI component MBMBGCFOFBJSGT-KUBAVDMBSA-N cis-4,7,10,13,16,19-Docosahexanoate DHA algae oil (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4, 7,10,13,16,19-hexaenoic acid Docosahexaenoate 1024594-51-1 Docoshexaenoic Acid (Powder) 4,7,10,13,16,19-Docosahexaenoic acid Espanova (TN) HMS3402A20 IDI1_033768 all cis- Docosahexaenoic acid (cis-DHA) MLS004773950 BCBcMAP01_000145 Omega 3 fatty acid CCG-207958 SR-05000002130-1 CHEMBL367149 z,z,z,z,z,z-docosa-4,7,10,13,16,19-hexaenoic acid D0Q5XX Doconexento (4Z,7Z,10Z,13Z,16Z,19Z)-Docosahexaenoic acid Docosahexaenoic acid (22:6(n-3)) 217D545 DSSTox_GSID_40465 4,7,10,13,16,19-Docosahexaenoic acid, (all cis)- GK0953 800E8E72-BBF4-46F7-A60B-B8F2B54669C7 AB01563379_01 M355 all-cis-docosa-4,7,10,13,16,19-hexaenoic acid NCGC00161345-01 BRD-K39965020-001-02-6 Ropufa 60 Cervonate UNII-71M78END5S component MBMBGCFOFBJSGT-KUBAVDMBSA-N cis-4,7,10,13,16,19-Docosahexaenoic acid, >=98% DB03756 (4Z,7Z,10Z,13Z,16Z, 19Z)-docosa-4,7,10,13,16,19-hexaenoic acid Doconexentum [INN-Latin] 1005411-64-2 docosahexaenoic acid(DHA) 25377-50-8 efalex 4-cis,7-cis,10-cis,13-cis,16-cis,19-cis-Docosahexaenoic acid HMS1791A20 HMS3649J15 AKOS015962159 MBMBGCFOFBJSGT-KUBAVDMBSA-N AquaGrow Advantage NCGC00161345-04 C22:6n-3,6,9,12,15,18 Spectrum5_002062 CHEBI:28125 UNII-F85N2YHE4E component MBMBGCFOFBJSGT-KUBAVDMBSA-N cis-4,7,10,13,16,19-Docosahexanoic acid Doconexent (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19- hexaenoic acid Doxonexent 4,7,10,13,16,19-Docosahexaenoic acid, (4Z,7Z,10Z,13Z,16Z,19Z)- FA 22:6 6217-54-5 KL-0761 all-cis-4,7,10,13,16,19-Docosahexaenoic acid MolPort-003-932-890 BDBM50210259 OMEGA-3 MARINE TRIGLYCERIDES CCG-208135 SR-05000002130-4 cis-4,7,10,13,16,19-Docosahexaenoic acid ZAD9OKH9JC D0R9ZP Doconexento [INN-Spanish] (all-Z)-4,7,10,13,16,19-Docosahexaenoic acid Docosahexaenoic acid (6CI) 22:6(n-3) DSSTox_RID_79498 4,7,10,13,16,19-Docosahexaenoic acid, (all-Z)- GTPL1051 952411-45-9 AC-1010 Marinol D 50TG all-Z-Docosahexaenoate NCGC00161345-02 BSPBio_001298 SCHEMBL19577 Cervonic acid UNII-96GS7P39SN component MBMBGCFOFBJSGT-KUBAVDMBSA-N cis-4,7,10,13,16,19-Docosahexaenoic acid, analytical standard delta4,7,10,13,16,19-Docosahexaenoic acid (4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-Docosahexaenoic acid DOCOSA-4,7,10,13,16,19-HEXAENOIC ACID 1008399-82-3 Docosahexaenoicacid 4,7,10,13,16,19-Docosahexaenoate Eicosapentaenoic acid/docosa-hexaenoic acid 4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoic acid HMS1989A20 HY-B2167 Algal DHA MFCD00065722 BC209734 NCGC00161345-05 CAS-6217-54-5 SR-05000002130 UNII-ZAD9OKH9JC CS-6261 Doconexent [INN] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoic acid DOCOSAHEXAENOIC ACID (22:6 n-3) 1fdq DSSTox_CID_20465 4,7,10,13,16,19-Docosahexaenoic acid, (4Z,7Z,10Z,13Z,16Z,19Z)- (9CI) FT-0082651 664303-42-8 LMFA01030185 all-cis-DHA Monolife 50 BML3-B02 Retriacyl (proposed trade name) CCRIS 7670 Tox21_111992 cis-4,7,10,13,16,19-Docosahexaenoic acid, 500 mug/mL in ethanol, certified reference material ZINC4474564 D2226 Doconexentum (all-Z)-4,7,10,13,16,19-Docosahexaenoic Acid, DHA Docosahexaenoic acid (all-Z) 231610-51-8 DTXSID5040465 4,7,10,13,16,19-Docosahexaenoic acid, (all-Z)- (8CI) HMS1361A20 A320050000 [ Show all ]
Inchi Key	MBMBGCFOFBJSGT-KUBAVDMBSA-N
Inchi ID	InChI=1S/C22H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
PubChem CID	445580
ChEMBL	CHEMBL367149
IUPHAR	1051
BindingDB	50210259
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
EC50	1000.0 - 3981.07 nM	PMID12496284, PMID12629551	IUPHAR
EC50	11700.0 nM	PMID27326330	BindingDB,ChEMBL
EC50	36000.0 nM	PMID24900539	BindingDB,ChEMBL
Efficacy	67.0 %	PMID24900539	ChEMBL

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