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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	CHEMBL96385
Molecular formula	C16H11N3O
IUPAC name	9-phenyl-3H-pyrimido[4,5-b]indol-4-one
Molecular weight	261.284
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	2.8
Synonyms	4-Hydroxy-9-phenyl-9H-pyrimido[4,5-b]indole 9-Phenyl-9H-1,3,9-triaza-fluoren-4-ol BDBM50014297 SCHEMBL14564553 9-Phenyl-3,9-dihydro-pyrimido[4,5-b]indol-4-one
Inchi Key	ZXMGBUXZYPSVIK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H11N3O/c20-16-14-12-8-4-5-9-13(12)19(15(14)17-10-18-16)11-6-2-1-3-7-11/h1-10H,(H,17,18,20)
PubChem CID	136044063
ChEMBL	CHEMBL96385
IUPHAR	N/A
BindingDB	50014297
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
439887	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
439888	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
439885	Adenosine receptor A2b	P29276	Adora2b	Rattus norvegicus (Rat)	332
439886	Adenosine receptor A3	P28647	Adora3	Rattus norvegicus (Rat)	320

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