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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	CHEMBL378388
Molecular formula	C28H34N4O4
IUPAC name	2-[5-cyclohexyl-1-(3,3-dimethyl-2-oxobutyl)-2-oxo-1,3,4-benzotriazepin-3-yl]-N-(3-hydroxyphenyl)acetamide
Molecular weight	490.604
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	4.9
Synonyms	BDBM50410848 SCHEMBL3910850
Inchi Key	DVFKNTWLTRDSFR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C28H34N4O4/c1-28(2,3)24(34)17-31-23-15-8-7-14-22(23)26(19-10-5-4-6-11-19)30-32(27(31)36)18-25(35)29-20-12-9-13-21(33)16-20/h7-9,12-16,19,33H,4-6,10-11,17-18H2,1-3H3,(H,29,35)
PubChem CID	11712880
ChEMBL	CHEMBL378388
IUPHAR	N/A
BindingDB	50410848
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
69882	Cholecystokinin receptor type A	P32238	CCKAR	Homo sapiens (Human)	428
69881	Gastrin/cholecystokinin type B receptor	P32239	CCKBR	Homo sapiens (Human)	447
69883	Gastrin/cholecystokinin type B receptor	P30553	Cckbr	Rattus norvegicus (Rat)	452

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