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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	2-Mesatp
Molecular formula	C11H18N5O13P3S
IUPAC name	[[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular weight	553.268
Hydrogen bond acceptor	18
Hydrogen bond donor	7
XlogP	-4.9
Synonyms	NCGC00163310-01 2-(Methylthio)-Adenosinetriphosphate 2-Methylthio-ATP ATP, 2-meS Y37441OBL1 43170-89-4 CHEMBL336208 DTXSID6037146 [[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate 2-(methylsulfanyl)adenosine 5'-(tetrahydrogen triphosphate) 2-Methylthio ATP tetrasodium AC1NSJRQ SCHEMBL375601 2-(methylthio)adenosine 5'-(tetrahydrogen triphosphate) 2-methylthioadenosine 5'-triphosphate BDBM50118232 ZINC3995334 2-Methyl-thio-ATP CTK7B5306 GTPL1711 2-(methylthio) adenosine 5'-triphosphate 2-methylthio-adenosine-5'-triphosphate AKOS027379934 UNII-Y37441OBL1 2-(METHYLTHIO)ADENOSINE-5'-TRIPHOSPHATE 2MeSATP [(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate 2-Methylthio ATP 6AT D0U1OJ [ Show all ]
Inchi Key	XNOBOKJVOTYSJV-KQYNXXCUSA-N
Inchi ID	InChI=1S/C11H18N5O13P3S/c1-33-11-14-8(12)5-9(15-11)16(3-13-5)10-7(18)6(17)4(27-10)2-26-31(22,23)29-32(24,25)28-30(19,20)21/h3-4,6-7,10,17-18H,2H2,1H3,(H,22,23)(H,24,25)(H2,12,14,15)(H2,19,20,21)/t4-,6-,7-,10-/m1/s1
PubChem CID	5310983
ChEMBL	CHEMBL336208
IUPHAR	1711
BindingDB	50118232
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. 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
396474	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
396470	P2Y purinoceptor 1	P47900	P2RY1	Homo sapiens (Human)	373
396473	P2Y purinoceptor 1	P49652	P2RY1	Meleagris gallopavo (Wild turkey)	362
396475	P2Y purinoceptor 1	P49651	P2ry1	Rattus norvegicus (Rat)	373
396471	P2Y purinoceptor 11	Q96G91	P2RY11	Homo sapiens (Human)	374
396477	P2Y purinoceptor 12	Q9EPX4	P2ry12	Rattus norvegicus (Rat)	343
555267	P2Y purinoceptor 13	Q9BPV8	P2RY13	Homo sapiens (Human)	354
396476	P2Y purinoceptor 6	Q15077	P2RY6	Homo sapiens (Human)	328

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