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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	CHEMBL3410310
Molecular formula	C20H22FN5O3
IUPAC name	ethyl 2-(2,2-dimethylpropyl)-6-[(4-fluorobenzoyl)amino]pyrazolo[3,4-d]pyrimidine-4-carboxylate
Molecular weight	399.426
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	3.7
Synonyms	BDBM50072943
Inchi Key	AOHCYMLALZJVBO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H22FN5O3/c1-5-29-18(28)15-14-10-26(11-20(2,3)4)25-16(14)23-19(22-15)24-17(27)12-6-8-13(21)9-7-12/h6-10H,5,11H2,1-4H3,(H,23,24,25,27)
PubChem CID	118732294
ChEMBL	CHEMBL3410310
IUPHAR	N/A
BindingDB	50072943
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
442107	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
442109	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
442106	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332
442108	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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