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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	Leukotriene B4 receptor 2
Species	Homo sapiens (Human)
Gene	LTB4R2
Synonym	NOP9 12-HHT receptor Seven transmembrane receptor BLTR2 LTB4-R2 LTB4-R 2 LTB4 receptor JULF2 Leukotriene B4 receptor BLT2 BLTR2 BLT2 receptor [ Show all ]
Disease	Inflammatory bowel disease
Length	358
Amino acid sequence	MSVCYRPPGNETLLSWKTSRATGTAFLLLAALLGLPGNGFVVWSLAGWRPARGRPLAATLVLHLALADGAVLLLTPLFVAFLTRQAWPLGQAGCKAVYYVCALSMYASVLLTGLLSLQRCLAVTRPFLAPRLRSPALARRLLLAVWLAALLLAVPAAVYRHLWRDRVCQLCHPSPVHAAAHLSLETLTAFVLPFGLMLGCYSVTLARLRGARWGSGRHGARVGRLVSAIVLAFGLLWAPYHAVNLLQAVAALAPPEGALAKLGGAGQAARAGTTALAFFSSSVNPVLYVFTAGDLLPRAGPRFLTRLFEGSGEARGGGRSREGTMELRTTPQLKVVGQGRGNGDPGGGMEKDGPEWDL
UniProt	Q9NPC1
Protein Data Bank	N/A
GPCR-HGmod model	Q9NPC1
3D structure model	This predicted structure model is from GPCR-EXP Q9NPC1.
BioLiP	N/A
Therapeutic Target Database	T30563
ChEMBL	CHEMBL3191
IUPHAR	268
DrugBank	BE0003489

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	(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 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 [ 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	5508, 3404
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	<30.0 nM	PMID11278893	IUPHAR

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