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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	CHEMBL117476
Molecular formula	C18H22ClN5O
IUPAC name	2-[3-[2-(3-chloro-N-methylanilino)ethylamino]propyl]-[1,2,4]triazolo[4,3-a]pyridin-3-one
Molecular weight	359.858
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.6
Synonyms	2-[3-[2-(3-Chloro-N-methylanilino)ethylamino]propyl]-1,2,4-triazolo[4,3-a]pyridine-3(2H)-one
Inchi Key	JHRGBWKUHXNWKQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H22ClN5O/c1-22(16-7-4-6-15(19)14-16)13-10-20-9-5-12-24-18(25)23-11-3-2-8-17(23)21-24/h2-4,6-8,11,14,20H,5,9-10,12-13H2,1H3
PubChem CID	10760958
ChEMBL	CHEMBL117476
IUPHAR	N/A
BindingDB	N/A
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
447676	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
151230	D(2) dopamine receptor	P61169	Drd2	Rattus norvegicus (Rat)	444
447675	Histamine H1 receptor	P30546	HRH1	Bos taurus (Bovine)	491

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