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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	CHEMBL1089040
Molecular formula	C20H27N5
IUPAC name	4-[(3R)-3-(methylamino)pyrrolidin-1-yl]-8-phenyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-2-amine
Molecular weight	337.471
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	3.2
Synonyms	BDBM50415768 SCHEMBL4067179
Inchi Key	ILOMBVURTLNCEQ-OEMAIJDKSA-N
Inchi ID	InChI=1S/C20H27N5/c1-22-16-10-11-25(13-16)19-17-9-5-8-15(14-6-3-2-4-7-14)12-18(17)23-20(21)24-19/h2-4,6-7,15-16,22H,5,8-13H2,1H3,(H2,21,23,24)/t15?,16-/m1/s1
PubChem CID	46881855
ChEMBL	CHEMBL1089040
IUPHAR	N/A
BindingDB	50415768
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
136156	Histamine H3 receptor	Q9QYN8	Hrh3	Rattus norvegicus (Rat)	445
136159	Histamine H3 receptor	Q9Y5N1	HRH3	Homo sapiens (Human)	445
136157	Histamine H4 receptor	Q91ZY1	Hrh4	Rattus norvegicus (Rat)	391
136158	Histamine H4 receptor	Q9H3N8	HRH4	Homo sapiens (Human)	390

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