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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	CHEMBL222156
Molecular formula	C35H45Cl2N7O5S
IUPAC name	2-[6-[4-[1-[[2,4-dichloro-3-[(2,4-dimethylquinolin-8-yl)oxymethyl]phenyl]sulfonylamino]cyclopentanecarbonyl]piperazin-1-yl]-6-oxohexyl]guanidine
Molecular weight	746.749
Hydrogen bond acceptor	8
Hydrogen bond donor	3
XlogP	4.0
Synonyms	BDBM50411266 SCHEMBL4060300
Inchi Key	BQIHVDDBUCQADT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C35H45Cl2N7O5S/c1-23-21-24(2)41-32-25(23)9-8-10-28(32)49-22-26-27(36)12-13-29(31(26)37)50(47,48)42-35(14-5-6-15-35)33(46)44-19-17-43(18-20-44)30(45)11-4-3-7-16-40-34(38)39/h8-10,12-13,21,42H,3-7,11,14-20,22H2,1-2H3,(H4,38,39,40)
PubChem CID	10441194
ChEMBL	CHEMBL222156
IUPHAR	N/A
BindingDB	50411266
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
30313	B1 bradykinin receptor	P46663	BDKRB1	Homo sapiens (Human)	353
30312	B2 bradykinin receptor	P30411	BDKRB2	Homo sapiens (Human)	391

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