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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	P2Y purinoceptor 1
Species	Rattus norvegicus (Rat)
Gene	P2ry1
Synonym	ATP receptor purinergic receptor P2Y Purinergic receptor platelet ADP receptor P2Y1 receptor P2Y1 P2Y purinoceptor 1 P2Y ATP receptor 1 P2 purinoceptor subtype Y1 Purinergic receptor P2Y1 [ Show all ]
Disease	N/A for non-human GPCRs
Length	373
Amino acid sequence	MTEVPWSAVPNGTDAAFLAGLGSLWGNSTIASTAAVSSSFRCALIKTGFQFYYLPAVYILVFIIGFLGNSVAIWMFVFHMKPWSGISVYMFNLALADFLYVLTLPALIFYYFNKTDWIFGDVMCKLQRFIFHVNLYGSILFLTCISAHRYSGVVYPLKSLGRLKKKNAIYVSVLVWLIVVVAISPILFYSGTGIRKNKTVTCYDSTSDEYLRSYFIYSMCTTVAMFCIPLVLILGCYGLIVRALIYKDLDNSPLRRKSIYLVIIVLTVFAVSYIPFHVMKTMNLRARLDFQTPEMCDFNDRVYATYQVTRGLASLNSCVDPILYFLAGDTFRRRLSRATRKASRRSEANLQSKSEEMTLNILSEFKQNGDTSL
UniProt	P49651
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2497
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	Ap3A
Molecular formula	C20H27N10O16P3
IUPAC name	bis[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate
Molecular weight	756.411
Hydrogen bond acceptor	24
Hydrogen bond donor	9
XlogP	-7.2
Synonyms	P1,P3-Bis(5'-adenosyl) triphosphate Adenosine (5')triphospho(5')adenosine BDBM50184368 DB01690 Adenosine(3)triphosphate adenosine C06197 P(1),P(3)-bis(5''-adenosyl) trihydrogen triphosphate P(1),P(3)-bis(5'-adenosyl) triphosphate A(5')p3(5')A CHEMBL407938 SCHEMBL1744586 Adenosine 5'-(tetrahydrogen triphosphate), P''-5'-ester with adenosine BIS(ADENOSINE)-5'-TRIPHOSPHATE diadenosine triphosphate P(1),P(3)-bis(5''-adenosyl) triphosphate 5959-90-0 adenosine(5'')triphospho(5'')adenosine CHEBI:27775 P(1),P(3)-bis(5'-adenosyl) trihydrogen triphosphate AC1L4WLI ApppA D0S5GU ZINC8220358 5'Ap3A Adenosine 5'-triphosphate 5'-adenosine bis[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hydrogen phosphate LS-15178 P(1),P(3)-bis(5'-adenosyl) trihydrogen triphosphate A(5'')p3(5'')A adenosine(5')triphospho(5')adenosine [ Show all ]
Inchi Key	QCICUPZZLIQAPA-XPWFQUROSA-N
Inchi ID	InChI=1S/C20H27N10O16P3/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(43-19)1-41-47(35,36)45-49(39,40)46-48(37,38)42-2-8-12(32)14(34)20(44-8)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-34H,1-2H2,(H,35,36)(H,37,38)(H,39,40)(H2,21,23,25)(H2,22,24,26)/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
PubChem CID	165381
ChEMBL	CHEMBL407938
IUPHAR	N/A
BindingDB	50184368
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.

Experimental Data

Parameter	Value	Reference	Database source
EC50	60.0 nM	PMID16539385	BindingDB,ChEMBL

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