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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	CHEMBL449406
Molecular formula	C21H24N4O
IUPAC name	3-methyl-N-[3-(1-methylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]benzamide
Molecular weight	348.45
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	3.2
Synonyms	SCHEMBL7007762 3-Methyl-N-[3-(1-methyl-piperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]-benzamide BDBM50130436 JZEMGYDWCXCAQQ-UHFFFAOYSA-N 5-(N-[3-methylbenzoyl]amino)-3-(1-methylpiperidin-4-yl)pyrrolo[3,2-b]pyridine
Inchi Key	JZEMGYDWCXCAQQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H24N4O/c1-14-4-3-5-16(12-14)21(26)24-19-7-6-18-20(23-19)17(13-22-18)15-8-10-25(2)11-9-15/h3-7,12-13,15,22H,8-11H2,1-2H3,(H,23,24,26)
PubChem CID	10926112
ChEMBL	CHEMBL449406
IUPHAR	N/A
BindingDB	50130436
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
163647	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
163644	5-hydroxytryptamine receptor 1B	P28222	HTR1B	Homo sapiens (Human)	390
163646	5-hydroxytryptamine receptor 1D	P28221	HTR1D	Homo sapiens (Human)	377
163645	5-hydroxytryptamine receptor 1F	P30939	HTR1F	Homo sapiens (Human)	366

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