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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-MeSADP
Molecular formula	C11H17N5O10P2S
IUPAC name	[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
Molecular weight	473.29
Hydrogen bond acceptor	15
Hydrogen bond donor	6
XlogP	-3.8
Synonyms	2-methylthio-ADP AKOS027379362 methylthio-ADP 2-(Methylthio)-Adenosinediphosphate 6AD CHEMBL435402 [(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate ((2S,3R,4S,5S)-5-(6-amino-2-(methylthio)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl trihydrogen diphosphate Adenosine 5'-(trihydrogen diphosphate), 2-(methylthio)- GTPL1710 [3H]2MeSADP 2MeSADP BDBM50118242 SCHEMBL195864 2-(Methylthio)adenosine 5'-diphosphate AC1L3TRY D0BB0O [({[(2R,3S,4R,5R)-5-[6-amino-2-(methylsulfanyl)-9H-purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid (3H)2-Mes-ADP 2-methylthio-adenosine-5'-diphosphate adenosine, 2-(methylthio)-, 5'-(trihydrogen diphosphate) GTPL1763 2-(methylsulfanyl)adenosine 5'-(trihydrogen diphosphate) ZINC3995387 ((2R,3S,4R,5R)-5-(6-amino-2-(methylthio)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl trihydrogen diphosphate 2-Mes-ADP AC1Q6S18 D0U7EQ [3H]2-methylthio-ADP [ Show all ]
Inchi Key	WLMZTKAZJUWXCB-KQYNXXCUSA-N
Inchi ID	InChI=1S/C11H17N5O10P2S/c1-29-11-14-8(12)5-9(15-11)16(3-13-5)10-7(18)6(17)4(25-10)2-24-28(22,23)26-27(19,20)21/h3-4,6-7,10,17-18H,2H2,1H3,(H,22,23)(H2,12,14,15)(H2,19,20,21)/t4-,6-,7-,10-/m1/s1
PubChem CID	121990
ChEMBL	CHEMBL435402
IUPHAR	1710, 1763
BindingDB	50118242
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.

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
376368	P2Y purinoceptor 1	P47900	P2RY1	Homo sapiens (Human)	373
376370	P2Y purinoceptor 1	P49652	P2RY1	Meleagris gallopavo (Wild turkey)	362
376372	P2Y purinoceptor 1	P49651	P2ry1	Rattus norvegicus (Rat)	373
555167	P2Y purinoceptor 12	Q9H244	P2RY12	Homo sapiens (Human)	342
555166	P2Y purinoceptor 13	Q9BPV8	P2RY13	Homo sapiens (Human)	354
376373	P2Y purinoceptor 2	P41231	P2RY2	Homo sapiens (Human)	377

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