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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	CHEMBL3422874
Molecular formula	C20H19N5OS
IUPAC name	2-(benzylamino)-6-(5-methyl-1H-pyrazole-3-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
Molecular weight	377.466
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	3.7
Synonyms	BDBM50083627
Inchi Key	ONWHHBPKKHKAJJ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H19N5OS/c1-13-9-17(24-23-13)20(26)25-8-7-15-16(10-21)19(27-18(15)12-25)22-11-14-5-3-2-4-6-14/h2-6,9,22H,7-8,11-12H2,1H3,(H,23,24)
PubChem CID	118735958
ChEMBL	CHEMBL3422874
IUPHAR	N/A
BindingDB	50083627
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
451391	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
451377	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
451392	Alpha-1A adrenergic receptor	P35348	ADRA1A	Homo sapiens (Human)	466
451383	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391
451384	C-C chemokine receptor type 2	P41597	CCR2	Homo sapiens (Human)	374
451388	C-C chemokine receptor type 4	P51679	CCR4	Homo sapiens (Human)	360
451394	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352
451381	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360
451386	C-X-C chemokine receptor type 4	P61073	CXCR4	Homo sapiens (Human)	352
451389	C-X-C chemokine receptor type 5	P32302	CXCR5	Homo sapiens (Human)	372
451385	Cannabinoid receptor 1	P21554	CNR1	Homo sapiens (Human)	472
451393	Delta-type opioid receptor	P41143	OPRD1	Homo sapiens (Human)	372
451387	Metabotropic glutamate receptor 1	Q13255	GRM1	Homo sapiens (Human)	1194
451379	Metabotropic glutamate receptor 2	Q14416	GRM2	Homo sapiens (Human)	872
451382	Metabotropic glutamate receptor 5	P41594	GRM5	Homo sapiens (Human)	1212
451390	Muscarinic acetylcholine receptor M1	P11229	CHRM1	Homo sapiens (Human)	460
451378	Muscarinic acetylcholine receptor M5	P08912	CHRM5	Homo sapiens (Human)	532
451380	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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