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GPCR

NameP2Y purinoceptor 6
SpeciesHomo sapiens (Human)
GeneP2RY6
Synonympyrimidinergic receptor P2Y
P2Y6 receptor
P2Y6
P2Y purinoceptor 6
P2Y ATP receptor 6
[ Show all ]
DiseaseN/A
Length328
Amino acid sequenceMEWDNGTGQALGLPPTTCVYRENFKQLLLPPVYSAVLAAGLPLNICVITQICTSRRALTRTAVYTLNLALADLLYACSLPLLIYNYAQGDHWPFGDFACRLVRFLFYANLHGSILFLTCISFQRYLGICHPLAPWHKRGGRRAAWLVCVAVWLAVTTQCLPTAIFAATGIQRNRTVCYDLSPPALATHYMPYGMALTVIGFLLPFAALLACYCLLACRLCRQDGPAEPVAQERRGKAARMAVVVAAAFAISFLPFHITKTAYLAVRSTPGVPCTVLEAFAAAYKGTRPFASANSVLDPILFYFTQKKFRRRPHELLQKLTAKWQRQGR
UniProtQ15077
Protein Data BankN/A
GPCR-HGmod modelQ15077
3D structure modelThis predicted structure model is from GPCR-EXP Q15077.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4714
IUPHAR326
DrugBankN/A

Ligand

NameCHEMBL445413
Molecular formulaC21H15N2O5S-
IUPAC name1-amino-4-(3-methylanilino)-9,10-dioxoanthracene-2-sulfonate
Molecular weight407.42
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP3.9
Synonymssodium 1-amino-9,10-dioxo-4-(m-tolylamino)-9,10-dihydroanthracene-2-sulfonate
BDBM50336787
sodium 4-(m-toluidino)-1-amino-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate
Inchi KeyAYMOWRNYHLSUHI-UHFFFAOYSA-M
Inchi IDInChI=1S/C21H16N2O5S/c1-11-5-4-6-12(9-11)23-15-10-16(29(26,27)28)19(22)18-17(15)20(24)13-7-2-3-8-14(13)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1
PubChem CID91932498
ChEMBLN/A
IUPHARN/A
BindingDB50336787
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
IC503920.0 nMPMID21207957BindingDB

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