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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	CHEMBL286739
Molecular formula	C13H16ClN5O3
IUPAC name	(1R,2R,3S,4R,5S)-4-[2-chloro-6-(methylamino)purin-9-yl]-1-(hydroxymethyl)bicyclo[3.1.0]hexane-2,3-diol
Molecular weight	325.753
Hydrogen bond acceptor	7
Hydrogen bond donor	4
XlogP	0.2
Synonyms	BDBM50100425 N-Methyl-2-chloro-9-[(1beta)-3alpha,4alpha-dihydroxy-5beta-(hydroxymethyl)bicyclo[3.1.0]hexane-2beta-yl]-9H-purine-6-amine (1R,2R,3S,4R,5S)-4-(2-Chloro-6-methylamino-purin-9-yl)-1-hydroxymethyl-bicyclo[3.1.0]hexane-2,3-diol
Inchi Key	FPCPEWCTMNCASH-XEMBYONJSA-N
Inchi ID	InChI=1S/C13H16ClN5O3/c1-15-10-6-11(18-12(14)17-10)19(4-16-6)7-5-2-13(5,3-20)9(22)8(7)21/h4-5,7-9,20-22H,2-3H2,1H3,(H,15,17,18)/t5-,7-,8+,9+,13+/m1/s1
PubChem CID	44276349
ChEMBL	CHEMBL286739
IUPHAR	N/A
BindingDB	50100425
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
538069	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
538066	5-hydroxytryptamine receptor 1B	P28222	HTR1B	Homo sapiens (Human)	390
538070	5-hydroxytryptamine receptor 1D	P28221	HTR1D	Homo sapiens (Human)	377
538071	5-hydroxytryptamine receptor 1E	P28566	HTR1E	Homo sapiens (Human)	365
538067	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
538068	5-hydroxytryptamine receptor 2B	P41595	HTR2B	Homo sapiens (Human)	481
538065	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
538062	5-hydroxytryptamine receptor 4	Q13639	HTR4	Homo sapiens (Human)	388
538061	5-hydroxytryptamine receptor 5A	P47898	HTR5A	Homo sapiens (Human)	357
538063	5-hydroxytryptamine receptor 6	P50406	HTR6	Homo sapiens (Human)	440
538064	5-hydroxytryptamine receptor 7	P34969	HTR7	Homo sapiens (Human)	479
83910	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
83909	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
445030	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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