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GPCR

NameAdenosine receptor A3
SpeciesRattus norvegicus (Rat)
GeneAdora3
SynonymARA3
Adenosine receptor A3
A3 receptor
TGPCR1
A3AR
DiseaseN/A for non-human GPCRs
Length320
Amino acid sequenceMKANNTTTSALWLQITYITMEAAIGLCAVVGNMLVIWVVKLNRTLRTTTFYFIVSLALADIAVGVLVIPLAIAVSLEVQMHFYACLFMSCVLLVFTHASIMSLLAIAVDRYLRVKLTVRYRTVTTQRRIWLFLGLCWLVSFLVGLTPMFGWNRKVTLELSQNSSTLSCHFRSVVGLDYMVFFSFITWILIPLVVMCIIYLDIFYIIRNKLSQNLTGFRETRAFYGREFKTAKSLFLVLFLFALCWLPLSIINFVSYFNVKIPEIAMCLGILLSHANSMMNPIVYACKIKKFKETYFVILRACRLCQTSDSLDSNLEQTTE
UniProtP28647
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3360
IUPHAR21
DrugBankN/A

Ligand

NameCHEMBL47437
Molecular formulaC16H17IN6O
IUPAC name3-iodo-N-[9-methyl-2-(propylamino)purin-6-yl]benzamide
Molecular weight436.257
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.1
Synonyms3-Iodo-N-(9-methyl-2-propylamino-9H-purin-6-yl)-benzamide
BDBM50034896
Inchi KeyFORRQBUVICVFDG-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H17IN6O/c1-3-7-18-16-21-13(12-14(22-16)23(2)9-19-12)20-15(24)10-5-4-6-11(17)8-10/h4-6,8-9H,3,7H2,1-2H3,(H2,18,20,21,22,24)
PubChem CID44293174
ChEMBLCHEMBL47437
IUPHARN/A
BindingDB50034896
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki20000.0 nMPMID7752196BindingDB,ChEMBL

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