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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	AC1L1GG2
Molecular formula	C18H19IN6O4
IUPAC name	3,4-dihydroxy-5-[6-[(3-iodophenyl)methylamino]purin-9-yl]-N-methyloxolane-2-carboxamide
Molecular weight	510.292
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	0.9
Synonyms	BRD-A20527803-001-01-2 3,4-dihydroxy-5-[6-[(3-iodophenyl)methylamino]purin-9-yl]-N-methyloxolane-2-carboxamide HMS3369A19 BCP09014 CHEBI:91576 3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9H-purin-9-yl)-N-methyloxolane-2-carboxamide L000303 BDBM50034171 3,4-Dihydroxy-5-[6-(3-iodo-benzylamino)-purin-9-yl]-tetrahydro-furan-2-carboxylic acid methylamide HMS3267E16 [ Show all ]
Inchi Key	HUJXGQILHAUCCV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H19IN6O4/c1-20-17(28)14-12(26)13(27)18(29-14)25-8-24-11-15(22-7-23-16(11)25)21-6-9-3-2-4-10(19)5-9/h2-5,7-8,12-14,18,26-27H,6H2,1H3,(H,20,28)(H,21,22,23)
PubChem CID	3668
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50034171
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
124383	5-hydroxytryptamine receptor 2B	P41595	HTR2B	Homo sapiens (Human)	481
124382	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
124386	Adenosine receptor A1	P49892	ADORA1	Gallus gallus (Chicken)	324
124388	Adenosine receptor A1	P34970	ADORA1	Oryctolagus cuniculus (Rabbit)	328
124387	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
124385	Adenosine receptor A2b	P29275	ADORA2B	Homo sapiens (Human)	332
124381	Adenosine receptor A3	O02667	ADORA3	Oryctolagus cuniculus (Rabbit)	319
124384	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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