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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.
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GPCR

Name	P2Y purinoceptor 2
Species	Homo sapiens (Human)
Gene	P2RY2
Synonym	Purinergic receptor purinergic receptor P2Y P2Y2 receptor P2Y2 P2Y purinoceptor 2 P2Y ATP receptor 2 P2U1 P2U receptor 1 P2U purinoceptor 1 ATP receptor [ Show all ]
Disease	Dry eye disease Constipation Cystic fibrosis Lung cancer
Length	377
Amino acid sequence	MAADLGPWNDTINGTWDGDELGYRCRFNEDFKYVLLPVSYGVVCVPGLCLNAVALYIFLCRLKTWNASTTYMFHLAVSDALYAASLPLLVYYYARGDHWPFSTVLCKLVRFLFYTNLYCSILFLTCISVHRCLGVLRPLRSLRWGRARYARRVAGAVWVLVLACQAPVLYFVTTSARGGRVTCHDTSAPELFSRFVAYSSVMLGLLFAVPFAVILVCYVLMARRLLKPAYGTSGGLPRAKRKSVRTIAVVLAVFALCFLPFHVTRTLYYSFRSLDLSCHTLNAINMAYKVTRPLASANSCLDPVLYFLAGQRLVRFARDAKPPTGPSPATPARRRLGLRRSDRTDMQRIEDVLGSSEDSRRTESTPAGSENTKDIRL
UniProt	P41231
Protein Data Bank	N/A
GPCR-HGmod model	P41231
3D structure model	This predicted structure model is from GPCR-EXP P41231.
BioLiP	N/A
Therapeutic Target Database	T93515
ChEMBL	CHEMBL4398
IUPHAR	324
DrugBank	BE0002401

Ligand

Name	5-Bromo-utp
Molecular formula	C9H14BrN2O15P3
IUPAC name	[[(2R,3S,4R,5R)-5-(5-bromo-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular weight	563.035
Hydrogen bond acceptor	15
Hydrogen bond donor	7
XlogP	-5.2
Synonyms	[(2R,3S,4R,5R)-5-(5-bromo-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl (hydroxy-phosphonooxyphosphoryl) hydrogen phosphate 161848-60-8 5-bromouridine 5'-triphosphate BUP CHEMBL384527 5-Br-Utp SCHEMBL625390 BDBM50199192 5-bromouridine triphosphate CHEBI:88358 D0P7RI 5-Bromo- 2', 3'- dideoxyuridine- 5'- O- triphosphate ( 5-Br-ddUTP ) 5BrUTP ZINC38149754 ((2R,3S,4R,5R)-5-(5-bromo-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl tetrahydrogen triphosphate 5-bromouridine 5'-(tetrahydrogen triphosphate) bromouridine 5'-triphosphate 3398-50-3 5-BromoUTP GTPL1731 5-bromo-1-beta-D-ribofuranosyl(3H)pyrimidine-2,4-dione 5''-triphosphate AKOS030532973 [ Show all ]
Inchi Key	IWFHOSULCAJGRM-UAKXSSHOSA-N
Inchi ID	InChI=1S/C9H14BrN2O15P3/c10-3-1-12(9(16)11-7(3)15)8-6(14)5(13)4(25-8)2-24-29(20,21)27-30(22,23)26-28(17,18)19/h1,4-6,8,13-14H,2H2,(H,20,21)(H,22,23)(H,11,15,16)(H2,17,18,19)/t4-,5-,6-,8-/m1/s1
PubChem CID	9872620
ChEMBL	CHEMBL384527
IUPHAR	1731
BindingDB	50199192
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	347.0 nM	PMID17125260	BindingDB,ChEMBL
EC50	750.0 nM	PMID17302398	BindingDB,ChEMBL
EC50	1995.26 nM	PMID8564228	IUPHAR
EC50	2060.0 nM	PMID20095577	BindingDB,ChEMBL

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