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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	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	1-Pentyl-3-(1-naphthoyl)indole
Molecular formula	C24H23NO
IUPAC name	naphthalen-1-yl-(1-pentylindol-3-yl)methanone
Molecular weight	341.454
Hydrogen bond acceptor	1
Hydrogen bond donor	0
XlogP	6.3
Synonyms	JWH-018 solution, 100 mug/mL in methanol, ampule of 1 mL, (Spice Cannabinoid), certified reference material PubChem14828 UNII-G391998J57 1-Naphthyl-(1-pentylindol-3-yl)methanone 3-(naphthalene-1-carbonyl)-1-pentyl-1H-indole AJ-63880 BCP27424 DB-003103 HSDB 7998 JWH 018 Methanone, 1-naphthalenyl(1-pentyl-1H-indol-3-yl)- RD-0094 1-pentyl-3-(1-naphthoyl)-indole AM-678 CCG-208715 DTXSID10175117 JWH-018 ((Naphthalen-1-yl)(1-pentylindol-3-yl)methanone) 0.1 mg/ml in Acetonitrile Naphthalen-1-yl-(1-pentylindol-3-yl)methanone SCHEMBL1707018 (1-Pentyl-1H-indol-3-yl)-1-naphthalenylmethanone 1-pentyl-3-1-naphthoyl-indole AB1010094 API0024564 CJ-14392 GTPL9706 JWH-018,1-Ii>>u-3-(1-YA(1/4)xo pound>>u)ssAssa Q-200132 W4386 1-Naphthyl-(1-pentylindol-3-yl)methanone; JWH-018 414P073 AKOS005145577 BDBM50353747 DEA No. 7118 I01-5097 JWH-018 naphthalen-1-yl(1-pentyl-1H-indol-3-yl)methanone RTC-064464 A4549 AN-11379 FT-0645403 JWH-018 ((Naphthalen-1-yl)(1-pentylindol-3-yl)methanone) 1.0 mg/ml in Acetonitrile NCGC00386566-01 TC-064464 1-Naphthalenyl(1-pentyl-1H-indol-3-yl)methanone 209414-07-3 ACT06673 BC652259 CTK3J6553 HIN1319 JDNLPKCAXICMBW-UHFFFAOYSA-N JWH018 QC-9204 ZINC13476531 1-Pentyl-3-(1-naphthoyl) indole AM 678 BR-31879 DS-3151 JWH-018 ((Naphthalen-1-yl)(1-pentylindol-3-yl)methanone) Naphthalen-1-yl-(1-pentyl-1H-indol-3-yl)-methanone S-5674 1-Pentyl-3-(1-naphthoyl)indoleJWH 018 AB0023351 ANW-47312 CHEMBL561013 G391998J57 [ Show all ]
Inchi Key	JDNLPKCAXICMBW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H23NO/c1-2-3-8-16-25-17-22(20-13-6-7-15-23(20)25)24(26)21-14-9-11-18-10-4-5-12-19(18)21/h4-7,9-15,17H,2-3,8,16H2,1H3
PubChem CID	10382701
ChEMBL	CHEMBL561013
IUPHAR	9706
BindingDB	50353747
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	1.3 nM	PMID22904561	BindingDB,ChEMBL

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