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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	CHEMBL3889627
Molecular formula	C23H27N5O3S
IUPAC name	N-[4-(2-cyanopyrrol-1-yl)-1-(4-methylpiperidin-1-yl)-1-oxobutan-2-yl]-1H-indole-4-sulfonamide
Molecular weight	453.561
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.6
Synonyms	BDBM50198921 SCHEMBL1034287
Inchi Key	BRJXJOWXAFLRTE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H27N5O3S/c1-17-8-13-28(14-9-17)23(29)21(10-15-27-12-3-4-18(27)16-24)26-32(30,31)22-6-2-5-20-19(22)7-11-25-20/h2-7,11-12,17,21,25-26H,8-10,13-15H2,1H3
PubChem CID	44252324
ChEMBL	CHEMBL3889627
IUPHAR	N/A
BindingDB	50198921
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
536788	5-hydroxytryptamine receptor 2A	P14842	Htr2a	Rattus norvegicus (Rat)	471
536782	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391
536791	C-C chemokine receptor type 1	P32246	CCR1	Homo sapiens (Human)	355
536780	C-C chemokine receptor type 10	Q9JL21	Ccr10	Mus musculus (Mouse)	362
536781	C-C chemokine receptor type 10	P46092	CCR10	Homo sapiens (Human)	362
536789	C-C chemokine receptor type 2	P41597	CCR2	Homo sapiens (Human)	374
536795	C-C chemokine receptor type 4	P51679	CCR4	Homo sapiens (Human)	360
536792	C-C chemokine receptor type 5	P51681	CCR5	Homo sapiens (Human)	352
536783	C-C chemokine receptor type 6	P51684	CCR6	Homo sapiens (Human)	374
536790	C-X-C chemokine receptor type 2	P25025	CXCR2	Homo sapiens (Human)	360
536784	C-X-C chemokine receptor type 3	P49682	CXCR3	Homo sapiens (Human)	368
536796	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
536785	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
536786	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
536794	Histamine H1 receptor	P35367	HRH1	Homo sapiens (Human)	487
536793	Histamine H2 receptor	P25021	HRH2	Homo sapiens (Human)	359
536797	Histamine H4 receptor	Q9H3N8	HRH4	Homo sapiens (Human)	390
536787	Type-1 angiotensin II receptor	P30556	AGTR1	Homo sapiens (Human)	359

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