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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	A-846714
Molecular formula	C16H18N6
IUPAC name	4-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzonitrile
Molecular weight	294.362
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	1.5
Synonyms	4-[2-amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]benzonitrile 2-Aminopyrimidine analog., 4 JMC516547 Compound 2 CHEMBL494678 SCHEMBL2166660 BDBM26229 D08DOG [ Show all ]
Inchi Key	QFKQUMBUFVKQBH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H18N6/c1-21-6-8-22(9-7-21)15-10-14(19-16(18)20-15)13-4-2-12(11-17)3-5-13/h2-5,10H,6-9H2,1H3,(H2,18,19,20)
PubChem CID	25130235
ChEMBL	CHEMBL494678
IUPHAR	N/A
BindingDB	26229
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
276957	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
276965	5-hydroxytryptamine receptor 1B	P28222	HTR1B	Homo sapiens (Human)	390
276968	5-hydroxytryptamine receptor 1D	P28221	HTR1D	Homo sapiens (Human)	377
276956	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
276969	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
276959	5-hydroxytryptamine receptor 7	P34969	HTR7	Homo sapiens (Human)	479
276967	Alpha-2A adrenergic receptor	P08913	ADRA2A	Homo sapiens (Human)	450
276962	Alpha-2C adrenergic receptor	P18825	ADRA2C	Homo sapiens (Human)	462
276964	Cannabinoid receptor 1	P21554	CNR1	Homo sapiens (Human)	472
276963	Histamine H3 receptor	Q9Y5N1	HRH3	Homo sapiens (Human)	445
276966	Histamine H3 receptor	Q9QYN8	Hrh3	Rattus norvegicus (Rat)	445
276958	Histamine H4 receptor	Q91ZY2	Hrh4	Mus musculus (Mouse)	391
276960	Histamine H4 receptor	Q9H3N8	HRH4	Homo sapiens (Human)	390
276961	Histamine H4 receptor	Q91ZY1	Hrh4	Rattus norvegicus (Rat)	391

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