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GPCR

NameP2Y purinoceptor 2
SpeciesHomo sapiens (Human)
GeneP2RY2
SynonymPurinergic receptor
purinergic receptor P2Y
P2Y2 receptor
P2Y2
P2Y purinoceptor 2
[ Show all ]
DiseaseDry eye disease
Constipation
Cystic fibrosis
Lung cancer
Length377
Amino acid sequenceMAADLGPWNDTINGTWDGDELGYRCRFNEDFKYVLLPVSYGVVCVPGLCLNAVALYIFLCRLKTWNASTTYMFHLAVSDALYAASLPLLVYYYARGDHWPFSTVLCKLVRFLFYTNLYCSILFLTCISVHRCLGVLRPLRSLRWGRARYARRVAGAVWVLVLACQAPVLYFVTTSARGGRVTCHDTSAPELFSRFVAYSSVMLGLLFAVPFAVILVCYVLMARRLLKPAYGTSGGLPRAKRKSVRTIAVVLAVFALCFLPFHVTRTLYYSFRSLDLSCHTLNAINMAYKVTRPLASANSCLDPVLYFLAGQRLVRFARDAKPPTGPSPATPARRRLGLRRSDRTDMQRIEDVLGSSEDSRRTESTPAGSENTKDIRL
UniProtP41231
Protein Data BankN/A
GPCR-HGmod modelP41231
3D structure modelThis predicted structure model is from GPCR-EXP P41231.
BioLiPN/A
Therapeutic Target DatabaseT93515
ChEMBLCHEMBL4398
IUPHAR324
DrugBankBE0002401

Ligand

NameCHEMBL1765120
Molecular formulaC15H19BrN3O14P3
IUPAC name[[[(2R,3S,4R,5R)-5-(5-bromo-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-N-phenylphosphonamidic acid
Molecular weight638.149
Hydrogen bond acceptor15
Hydrogen bond donor7
XlogP-2.3
Synonyms5-Bromo-1-beta-D-ribofuranosyl(3H)pyrimidine-2,4-dione 5''-(gamma-phenylamino)triphosphate
BDBM50341902
Inchi KeyBECOTGWWMSOOEA-HKUMRIAESA-N
Inchi IDInChI=1S/C15H19BrN3O14P3/c16-9-6-19(15(23)17-13(9)22)14-12(21)11(20)10(31-14)7-30-35(26,27)33-36(28,29)32-34(24,25)18-8-4-2-1-3-5-8/h1-6,10-12,14,20-21H,7H2,(H,26,27)(H,28,29)(H,17,22,23)(H2,18,24,25)/t10-,11-,12-,14-/m1/s1
PubChem CID52952183
ChEMBLCHEMBL1765120
IUPHARN/A
BindingDB50341902
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis 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

ParameterValueReferenceDatabase source
EC501800.0 nMPMID21417463BindingDB,ChEMBL

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