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GLASS

You can:

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	Cannabinoid receptor 2
Species	Homo sapiens (Human)
Gene	CNR2
Synonym	Peripheral cannabinoid receptor rCB2 hCB2 cannabinoid receptor 2 (macrophage) cannabinoid receptor 2 (spleen) CB-2 CB2 CB2 receptor CB2-R CX5 [ Show all ]
Disease	Immune disorder Inflammatory bowel disease Inflammatory disease Neuropathic pain Osteoporosis Pain Atopic dermatitis Rheumatoid arthritis [ Show all ]
Length	360
Amino acid sequence	MEECWVTEIANGSKDGLDSNPMKDYMILSGPQKTAVAVLCTLLGLLSALENVAVLYLILSSHQLRRKPSYLFIGSLAGADFLASVVFACSFVNFHVFHGVDSKAVFLLKIGSVTMTFTASVGSLLLTAIDRYLCLRYPPSYKALLTRGRALVTLGIMWVLSALVSYLPLMGWTCCPRPCSELFPLIPNDYLLSWLLFIAFLFSGIIYTYGHVLWKAHQHVASLSGHQDRQVPGMARMRLDVRLAKTLGLVLAVLLICWFPVLALMAHSLATTLSDQVKKAFAFCSMLCLINSMVNPVIYALRSGEIRSSAHHCLAHWKKCVRGLGSEAKEEAPRSSVTETEADGKITPWPDSRDLDLSDC
UniProt	P34972
Protein Data Bank	5zty
GPCR-HGmod model	P34972
3D structure model	This structure is from PDB ID 5zty.
BioLiP	BL0438927
Therapeutic Target Database	T37693
ChEMBL	CHEMBL253
IUPHAR	57
DrugBank	BE0000095

Ligand

Name	UNII-5F4WO3BVS9
Molecular formula	C16H29NO
IUPAC name	(2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide
Molecular weight	251.414
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	5.5
Synonyms	(2E,4E)-N-Isobutyl-2,4-dodecadienamide D0EC6B N-isobutyl-(2E,4E)-dodecadienamide 2,4-(E,E)-Dodecadienoylisobutylamide BBRMJCAPNGJKEM-AQASXUMVSA-N Kalecide NCGC00384562-01!(2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide (2E,4E)-N-(2-Methylpropyl)-2,4-dodecadienamide 2,4-Dodecadienamide, N-isobutyl-, (E,E)- N-(2-Methylpropyl)-2,4-dodecadienamide ZINC36294914 (2e,4e)-n-isobutyldodeca-2,4-dienamide 5F4WO3BVS9 dodeca-2E,4E-dienoic acid isobutylamide N-Isobutyl-(2E,4E-dodeca-2,4-dienamide 2,4-Dodecadienamide, N-(2-methylpropyl)-, (2E,4E)- BDBM50212599 MCULE-7934862818 SCHEMBL2262688 (2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide 24738-51-0 CHEMBL426912 N-Isobutyl-(2E,4E)-dodeca-2,4-dienamide (E,E)-N-Isobutyl-2,4-dodecadienamide AC1O5Y9Z Dodecatetraenoic acid isobutylamide, (2E,4E)- N-Isobutyldodeca-trans-2,4-dienamide 2,4-Dodecadienamide, N-(2-methylpropyl)-, (E,E)- CHEBI:70101 MolPort-005-944-951 [ Show all ]
Inchi Key	BBRMJCAPNGJKEM-AQASXUMVSA-N
Inchi ID	InChI=1S/C16H29NO/c1-4-5-6-7-8-9-10-11-12-13-16(18)17-14-15(2)3/h10-13,15H,4-9,14H2,1-3H3,(H,17,18)/b11-10+,13-12+
PubChem CID	6443006
ChEMBL	CHEMBL426912
IUPHAR	N/A
BindingDB	50212599
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
Activity	50.0 %	PMID17497806	ChEMBL
Ki	52.0 nM	PMID17497806	BindingDB,ChEMBL

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