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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.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	12-(S)-hydroxy-5,8,10,14-eicosatetraenoic acid receptor
Species	Mus musculus (Mouse)
Gene	Gpr31
Synonym	12-(S)-HETE acid receptor HETER1 GPR31 G-protein coupled receptor 31 G protein-coupled receptor 31, D17Leh66c region 12-HETER 12-(S)-HETE receptor hydroxyeicosatetraenoic (HETE) acid receptor 1 [ Show all ]
Disease	N/A for non-human GPCRs
Length	319
Amino acid sequence	MERTNCSAASTVVETAVGTMLTLECVLGLMGNAVALWTFFYRLKVWKPYAVYLFNLVVADLLLATSLPFFAAFYLKGKTWKLGHMPCQVLLFLLAFSRGVGVAFLTTVALDRYLRVVHPRLRVNLLSLRAAWGISSLIWLLMVVLTPQNLLTCRTTQNSTECPSFYPTGGAKAIATCQEVLFFLQVLLPFGLISFCNSGLIRTLQKRLRESDKQPRIRRARVLVAIVLLLFGLCFLPSVLTRVLVHIFQEFKSCSVQQAIVRASDIAGSLTCLHSTLSPAIYCFSNPAFTHSYRKVLKSLRGRRKAAESPSDNLRDSYS
UniProt	F8VQN3
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	N/A
IUPHAR	98
DrugBank	N/A

Ligand

Name	12(S)-HETE
Molecular formula	C20H32O3
IUPAC name	(5Z,8Z,10E,12S,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoic acid
Molecular weight	320.473
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	5.2
Synonyms	1166AH 12(S)-Hydroxyeicosatetraenoic acid CHEMBL1526258 HMS3402A21 ZINC4655428 (5Z,8Z,10E,12S,14Z)-12-hydroxyeicosa-5,8,10,14-tetraenoic acid 12(S)-Hydroxy (5Z,8Z,10E,14Z)-Eicosatetraenoic Acid 12-Hydroxyeicosatetraenoic acid AC1NR1NB GTPL3404 MFCD00036916 (5Z,8Z,10E,14Z)-(12S)-12-Hydroxyicosa-5,8,10,14-tetraenoic acid 12(S)-hydroxy-5(Z),8(Z),10(E),14(Z)-eicosatetraenoic acid 12S-hydroxy-5Z,8Z,10E,14Z-eicosatetraenoic acid C14777 HMS1791A21 NCGC00161240-03 12 hete 12-Hete 54397-83-0 D0D5EX IDI1_033769 [S-(E,Z,Z,Z)]-12-Hydroxy-5,8,10,14-eicosatetraenoic Acid (5Z,8Z,10E,12S,14Z)-12-hydroxyicosa-5,8,10,14-tetraenoic acid 12(S)-Hydroxy-(5Z,8Z,10E,14Z)-eicosatetraenoic acid 12-L-Hydroxy-5,8,10,14-eicosatetraenoic acid BML1-B07 GTPL5508 NCGC00161240-01 (S)-12-HETE 12(S)-hydroxy-5,8,14(Z),10(E)-eicosatetraenoic acid 12S-[3H]HETE CHEBI:34146 HMS1989A21 SCHEMBL1242004 (12S)-12-hydroxy-5,8,14-cis-10-trans-eicosatetraenoic acid 12-HYDROXY-5,8,10,14-EICOSATETRAENOIC ACID D0Z5QA LMFA03060007 (5Z,8Z,10E,14Z)-(12S)-12-Hydroxyeicosa-5,8,10,14-tetraenoic acid 12(S)-Hydroxy-(5Z,8Z,10E,14Z)-eicosatetraenoic acid, ~100 mug/mL in ethanol, >=95% (HPLC) 12S-HETE BSPBio_001299 HMS1361A21 NCGC00161240-02 [ Show all ]
Inchi Key	ZNHVWPKMFKADKW-LQWMCKPYSA-N
Inchi ID	InChI=1S/C20H32O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h7-11,13-14,17,19,21H,2-6,12,15-16,18H2,1H3,(H,22,23)/b9-7-,11-8-,13-10-,17-14+/t19-/m0/s1
PubChem CID	5283155
ChEMBL	N/A
IUPHAR	3404, 5508
BindingDB	N/A
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	0.28 nM	PMID21712392	IUPHAR
Kd	4.87 nM	PMID21712392	IUPHAR

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