Zhang Lab

National University of Singapore

Home Research COVID-19 Services Publications People Teaching Job Opening News Forum Lab Only

Online Services

●I-TASSER ●I-TASSER-MTD ●C-I-TASSER ●CR-I-TASSER ●QUARK ●C-QUARK ●LOMETS ●MUSTER ●CEthreader ●SEGMER ●DeepFold ●DeepFoldRNA ●FoldDesign ●COFACTOR ●COACH ●MetaGO ●TripletGO ●IonCom ●FG-MD ●ModRefiner ●REMO ●DEMO ●DEMO-EM ●SPRING ●COTH ●Threpp ●PEPPI ●BSpred ●ANGLOR ●EDock ●BSP-SLIM ●SAXSTER ●FUpred ●ThreaDom ●ThreaDomEx ●EvoDesign ●BindProf ●BindProfX ●SSIPe ●GPCR-I-TASSER ●MAGELLAN ●ResQ ●STRUM ●DAMpred

●TM-score ●TM-align ●US-align ●MM-align ●RNA-align ●NW-align ●LS-align ●EDTSurf ●MVP ●MVP-Fit ●SPICKER ●HAAD ●PSSpred ●3DRobot ●MR-REX ●I-TASSER-MR ●SVMSEQ ●NeBcon ●ResPRE ●TripletRes ●DeepPotential ●WDL-RF ●ATPbind ●DockRMSD ●DeepMSA ●FASPR ●EM-Refiner ●GPU-I-TASSER

●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	Adrenoyl-EA
Molecular formula	C24H41NO2
IUPAC name	(7Z,10Z,13Z,16Z)-N-(2-hydroxyethyl)docosa-7,10,13,16-tetraenamide
Molecular weight	375.597
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	6.4
Synonyms	ANANDAMIDE (22:4,n-6) CHEBI:34478 FMVHVRYFQIXOAF-DOFZRALJSA-N LMFA08040047 N-docosatetraenoylethanolamine SR-01000946675-1 7,10,13,16-Docosatetraenylethanolamide AC1NQZRP BML2-C01 D0Q4DB HMS1791M17 N-(2-Hydroxyethyl)-7Z,10Z,13Z,16Z-docosatetraenamide NCGC00161197-05 (7Z,10Z,13Z,16Z)-N-(2-hydroxyethyl)docosa-7,10,13,16-tetraenamide Adrenoyl-ethanolamine C13829 Docosatetra-7Z,10Z,13Z,16Z-Enoyl Ethanolamide HMS3649L17 N-(7Z,10Z,13Z,16Z-docosatetraenoyl)-ethanolamine SCHEMBL6259736 7,10,13,16-Docosatetraenamide, N-(2-hydroxyethyl)-, (all-Z)- 7,10,13,16-DTEA Anandamide + PMSF GTPL5445 MolPort-003-983-551 NCGC00161197-03 ZINC4654958 Adrenoyl ethanolamide BRD-K30199352-001-02-9 Docosa-7,10,13,16-tetraenoate HMS1989M17 N-(2-Hydroxyethyl)7Z,10Z,13Z,16Z-docosatetraenamide NCGC00161197-06 150314-35-5 AKOS024456629 C24H41NO2 Docosatetraenylethanolamide IDI1_034005 N-docosatetra-7,10,13,16-enoylethanolamine SR-01000946675 7,10,13,16-Docosatetraenoylethanolamine BDBM85675 CHEMBL321585 HMS1361M17 N-(2-Hydroxyethyl)-7,10,13,16-docosatetraenamide (all-Z)- NCGC00161197-04 BSPBio_001535 Docosa-7,10,13,16-tetraenoic acid (2-hydroxy-ethyl)-amide HMS3402M17 N-(7Z,10Z,13Z,16Z-docosatetraenoyl)-ethanolamide NCGC00161197-07 1699AH [ Show all ]
Inchi Key	FMVHVRYFQIXOAF-DOFZRALJSA-N
Inchi ID	InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(27)25-22-23-26/h6-7,9-10,12-13,15-16,26H,2-5,8,11,14,17-23H2,1H3,(H,25,27)/b7-6-,10-9-,13-12-,16-15-
PubChem CID	5282273
ChEMBL	CHEMBL321585
IUPHAR	N/A
BindingDB	85675
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
82300	Cannabinoid receptor 1	Q9PUI7	CNR1	Taricha granulosa (Roughskin newt)	473
82301	Cannabinoid receptor 1	P56971	CNR1	Taeniopygia guttata (Zebra finch)	473
82302	Cannabinoid receptor 1	P20272	Cnr1	Rattus norvegicus (Rat)	473
82303	Cannabinoid receptor 1	P21554	CNR1	Homo sapiens (Human)	472

zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417