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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	AC1LA9RB
Molecular formula	C11H13ClN4O3
IUPAC name	(2R,3S,5R)-5-(7-amino-5-chloroimidazo[4,5-b]pyridin-3-yl)-2-(hydroxymethyl)oxolan-3-ol
Molecular weight	284.7
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	1.1
Synonyms	(2R,3S,5R)-5-(7-amino-5-chloroimidazo[4,5-b]pyridin-3-yl)-2-(hydroxymethyl)oxolan-3-ol 3-(2-Deoxy-beta-D-erythro-pentofuranosyl)-5-chloro-3H-imidazo[4,5-b]pyridine-7-amine CHEMBL3142967 2-Chloro-2'-deoxy-1-deazaadenosine (2R,3S,5R)-5-(7-amino-5-chloro-imidazo[4,5-b]pyridin-3-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol 2Cl-1-Deaza-2'-dA [ Show all ]
Inchi Key	DUCXWDWEQQGOTG-LKEWCRSYSA-N
Inchi ID	InChI=1S/C11H13ClN4O3/c12-8-1-5(13)10-11(15-8)16(4-14-10)9-2-6(18)7(3-17)19-9/h1,4,6-7,9,17-18H,2-3H2,(H2,13,15)/t6-,7+,9+/m0/s1
PubChem CID	464418
ChEMBL	CHEMBL3142967
IUPHAR	N/A
BindingDB	N/A
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
68906	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
68905	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
68904	Adenosine receptor A3	P28647	Adora3	Rattus norvegicus (Rat)	320

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