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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	Donitriptan
Molecular formula	C23H25N5O2
IUPAC name	4-[4-[2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]acetyl]piperazin-1-yl]benzonitrile
Molecular weight	403.486
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.2
Synonyms	70968BVH2J Donitriptan [INN] Migraine therapy, Pierre Fabre 170912-52-4 BENZONITRILE,4-[4-[2-[[3-(2-AMINOETHYL)-1H-INDOL-5-YL]OXY]ACETYL]-1-PIPERAZINYL]- F-11356 UNII-70968BVH2J 4-[4-[2-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]acetyl]piperazin-1-yl]benzonitrile L000746 1-(((3-(2-Aminoethyl)indol-5-yl)oxy)acetyl)-4-(p-cyanophenyl)piperazine AC1L53VE DTXSID20168974 NCGC00370895-01 2-[5-[2-[4-(4-cyanophenyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]-1~{H}-indol-3-yl]ethylazanium CHEMBL1742428 F-12640 ZINC579168 5-HT1D agonist, Pierre Fabre Donitriptan mesylate LS-193882 1-(((3-(2-Aminoethyl)indol-5-yl)oxy)acetyl)-4-(p-cyanophenyl)piperazine. ACM170912524 EP5 SCHEMBL1388876 D0G5ML GTPL39 [ Show all ]
Inchi Key	SOHCKWZVTCTQBG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H25N5O2/c24-8-7-18-15-26-22-6-5-20(13-21(18)22)30-16-23(29)28-11-9-27(10-12-28)19-3-1-17(14-25)2-4-19/h1-6,13,15,26H,7-12,16,24H2
PubChem CID	197706
ChEMBL	N/A
IUPHAR	39
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
554854	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
554850	5-hydroxytryptamine receptor 1B	P28564	Htr1b	Rattus norvegicus (Rat)	386
554853	5-hydroxytryptamine receptor 1B	P28222	HTR1B	Homo sapiens (Human)	390
554851	5-hydroxytryptamine receptor 1D	P28565	Htr1d	Rattus norvegicus (Rat)	374
554855	5-hydroxytryptamine receptor 1D	P28221	HTR1D	Homo sapiens (Human)	377
554849	5-hydroxytryptamine receptor 1E	P28566	HTR1E	Homo sapiens (Human)	365
554852	5-hydroxytryptamine receptor 1F	P30939	HTR1F	Homo sapiens (Human)	366
554846	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
554847	5-hydroxytryptamine receptor 5A	P47898	HTR5A	Homo sapiens (Human)	357
554848	5-hydroxytryptamine receptor 6	P50406	HTR6	Homo sapiens (Human)	440

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