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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	N6-2-(4-Aminophenyl)ethyladenosine
Molecular formula	C18H22N6O4
IUPAC name	2-[6-[2-(4-aminophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Molecular weight	386.412
Hydrogen bond acceptor	9
Hydrogen bond donor	5
XlogP	0.9
Synonyms	CHEMBL326958 L000691 NCGC00015017-05 Tox21_500118 2-(6-{[2-(4-aminophenyl)ethyl]amino}-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol AC1Q4Y3F D0U6NZ n-[2-(4-aminophenyl)ethyl]-9-pentofuranosyl-9h-purin-6-amine NCGC00093612-03 CCG-204213 GTPL462 NCGC00015017-03 SR-01000075222 A-202 ChEMBL_198532 Lopac0_000118 NCGC00093612-01 [125I]APNEA 2-[6-[2-(4-aminophenyl)ethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol APNEA EU-0100118 NCGC00260803-01 HMS3260G18 NCGC00015017-04 SR-01000075222-1 AC1L1I2P D0A8EK LP00118 NCGC00093612-02 [3H]N6-2-(4-Aminophenyl)ethyladenosine 2-{6-[2-(4-Amino-phenyl)-ethylamino]-purin-9-yl}-5-hydroxymethyl-tetrahydro-furan-3,4-diol BDBM50037785 GTPL417 NCGC00015017-02 SCHEMBL16585344 [ Show all ]
Inchi Key	XTPOZVLRZZIEBW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H22N6O4/c19-11-3-1-10(2-4-11)5-6-20-16-13-17(22-8-21-16)24(9-23-13)18-15(27)14(26)12(7-25)28-18/h1-4,8-9,12,14-15,18,25-27H,5-7,19H2,(H,20,21,22)
PubChem CID	4397
ChEMBL	CHEMBL326958
IUPHAR	417, 462
BindingDB	50037785
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
400603	Adenosine receptor A1	P34970	ADORA1	Oryctolagus cuniculus (Rabbit)	328
555278	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
400602	Adenosine receptor A3	O02667	ADORA3	Oryctolagus cuniculus (Rabbit)	319
555279	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318
400606	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
400607	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371

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