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GPCR

NameAdenosine receptor A2b
SpeciesMus musculus (Mouse)
GeneAdora2b
SynonymA2b
A2B receptor
A2BR
adenosine receptor A2b
DiseaseN/A for non-human GPCRs
Length332
Amino acid sequenceMQLETQDALYVALELVIAALAVAGNVLVCAAVGASSALQTPTNYFLVSLATADVAVGLFAIPFAITISLGFCTDFHGCLFLACFVLVLTQSSIFSLLAVAVDRYLAIRVPLRYKGLVTGTRARGIIAVLWVLAFGIGLTPFLGWNSKDSATSNCTELGDGIANKSCCPVTCLFENVVPMSYMVYFNFFGCVLPPLLIMLVIYIKIFMVACKQLQRMELMDHSRTTLQREIHAAKSLAMIVGIFALCWLPVHAINCITLFHPALAKDKPKWVMNVAILLSHANSVVNPIVYAYRNRDFRYSFHKIISRYVLCQAETKGGSGQAGAQSTLSLGL
UniProtQ60614
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2237
IUPHAR20
DrugBankN/A

Ligand

Namecaffeine
Molecular formulaC8H10N4O2
IUPAC name1,3,7-trimethylpurine-2,6-dione
Molecular weight194.194
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP-0.1
SynonymsEnerjets
BIM-0050216.0001
Caffeine solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material
3378-EP2295434A2
GlaxoSmithKline Brand of Caffeine
[ Show all ]
Inchi KeyRYYVLZVUVIJVGH-UHFFFAOYSA-N
Inchi IDInChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3
PubChem CID2519
ChEMBLCHEMBL113
IUPHAR407
BindingDB10849
DrugBankDB00201

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Kb25000.0 nMPMID12139454ChEMBL
Ki13000.0 nMPMID8135856IUPHAR

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