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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	Cannabinoid receptor 1
Species	Mus musculus (Mouse)
Gene	Cnr1
Synonym	SKR6R Neuronal cannabinoid receptor Central cannabinoid receptor CB1R CB1 receptor CB1 CB-R Cann7 Cann6 Brain-type cannabinoid receptor THC receptor [ Show all ]
Disease	N/A for non-human GPCRs
Length	473
Amino acid sequence	MKSILDGLADTTFRTITTDLLYVGSNDIQYEDIKGDMASKLGYFPQKFPLTSFRGSPFQEKMTAGDNSPLVPAGDTTNITEFYNKSLSSFKENEDNIQCGENFMDMECFMILNPSQQLAIAVLSLTLGTFTVLENLLVLCVILHSRSLRCRPSYHFIGSLAVADLLGSVIFVYSFVDFHVFHRKDSPNVFLFKLGGVTASFTASVGSLFLTAIDRYISIHRPLAYKRIVTRPKAVVAFCLMWTIAIVIAVLPLLGWNCKKLQSVCSDIFPLIDETYLMFWIGVTSVLLLFIVYAYMYILWKAHSHAVRMIQRGTQKSIIIHTSEDGKVQVTRPDQARMDIRLAKTLVLILVVLIICWGPLLAIMVYDVFGKMNKLIKTVFAFCSMLCLLNSTVNPIIYALRSKDLRHAFRSMFPSCEGTAQPLDNSMGDSDCLHKHANNTASMHRAAESCIKSTVKIAKVTMSVSTDTSAEAL
UniProt	P47746
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	CHEMBL3037
IUPHAR	56
DrugBank	N/A

Ligand

Name	CHEMBL309042
Molecular formula	C23H38FNO
IUPAC name	(5Z,8Z,11Z,14Z)-N-(2-fluoroethyl)-2-methylicosa-5,8,11,14-tetraenamide
Molecular weight	363.561
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	7.0
Synonyms	AC1NR2AD LMFA08020056 SR-01000946638-1 (+/-)-2-Methylarachidonoyl-2'-fluoroethylamide, >=95%, ethanol solution 166100-39-6 N-(2-fluro-ethyl) 2-methyl-arachidonoyl amine 2-methylarachidonoyl-(2'-fluoroethyl)amide HMS3649B17 SCHEMBL12631857 AKOS030531014 MFCD01862615 (5Z,8Z,11Z,14Z)-2-Methyl-icosa-5,8,11,14-tetraenoic acid (2-fluoro-ethyl)-amide 2-Methyl-2'-fluoro AEA N-(2-fluro-ethyl)-2-methyl-5Z,8Z,11Z,14Z-eicosatetraenoyl amine J-010256 SR-01000946638 (+/-)-2-Methylarachidonoyl-2'-fluoroethylamide (5Z,8Z,11Z,14Z)-N-(2-fluoroethyl)-2-methylicosa-5,8,11,14-tetraenamide BDBM50060617 MolPort-009-018-834 2-Methyl-icosa-5,8,11,14-tetraenoic acid (2-fluoro-ethyl)-amide (0689) Fluoromethanandamide N-(2-fluro-ethyl)2-methylarachidonoylamide [ Show all ]
Inchi Key	HMMNZALKMVCHHZ-ZKWNWVNESA-N
Inchi ID	InChI=1S/C23H38FNO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(2)23(26)25-21-20-24/h7-8,10-11,13-14,16-17,22H,3-6,9,12,15,18-21H2,1-2H3,(H,25,26)/b8-7-,11-10-,14-13-,17-16-
PubChem CID	5283437
ChEMBL	CHEMBL309042
IUPHAR	N/A
BindingDB	50060617
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
Ki	5.7 nM	PMID9357528	BindingDB,ChEMBL
Ki	15.0 nM	PMID9357528	BindingDB,ChEMBL

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