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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	CHEMBL1098185
Molecular formula	C22H28N6
IUPAC name	7-benzyl-5-N-cyclohexyl-2,6,8,9-tetrahydropyrazolo[3,4-c][2,7]naphthyridine-1,5-diamine
Molecular weight	376.508
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	4.0
Synonyms	7-benzyl-N~5~-cyclohexyl-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridine-1,5-diamine ZINC20100317 MolPort-006-382-464 AKOS005434930 7-benzyl-N5-cyclohexyl-6,7,8,9-tetrahydro-3H-pyrazolo[3,4-c][2,7]naphthyridine-1,5-diamine STK354826 BDBM50317470 MCULE-2396550014 [ Show all ]
Inchi Key	ANCYCLDLQNJWMK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H28N6/c23-20-19-17-11-12-28(13-15-7-3-1-4-8-15)14-18(17)21(25-22(19)27-26-20)24-16-9-5-2-6-10-16/h1,3-4,7-8,16H,2,5-6,9-14H2,(H4,23,24,25,26,27)
PubChem CID	25249151
ChEMBL	CHEMBL1098185
IUPHAR	N/A
BindingDB	50317470
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
9463	Bombesin receptor subtype-3	Q8K418	Brs3	Rattus norvegicus (Rat)	399
9464	Bombesin receptor subtype-3	P32247	BRS3	Homo sapiens (Human)	399

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