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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	JMC516547 Compound 5
Molecular formula	C15H16N6
IUPAC name	4-(2-amino-6-piperazin-1-ylpyrimidin-4-yl)benzonitrile
Molecular weight	280.335
Hydrogen bond acceptor	6
Hydrogen bond donor	2
XlogP	1.0
Synonyms	SCHEMBL2166460 4-[2-amino-6-(piperazin-1-yl)pyrimidin-4-yl]benzonitrile CHEMBL494890 2-Aminopyrimidine analog., 25 BDBM26230
Inchi Key	GXPQVRIHPFBPOG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H16N6/c16-10-11-1-3-12(4-2-11)13-9-14(20-15(17)19-13)21-7-5-18-6-8-21/h1-4,9,18H,5-8H2,(H2,17,19,20)
PubChem CID	25130576
ChEMBL	CHEMBL494890
IUPHAR	N/A
BindingDB	26230
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
107815	Histamine H3 receptor	Q9Y5N1	HRH3	Homo sapiens (Human)	445
107818	Histamine H3 receptor	Q9QYN8	Hrh3	Rattus norvegicus (Rat)	445
107814	Histamine H4 receptor	Q91ZY2	Hrh4	Mus musculus (Mouse)	391
107816	Histamine H4 receptor	Q9H3N8	HRH4	Homo sapiens (Human)	390
107817	Histamine H4 receptor	Q91ZY1	Hrh4	Rattus norvegicus (Rat)	391

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