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GPCR

NameAlpha-2A adrenergic receptor
SpeciesBos taurus (Bovine)
GeneADRA2A
SynonymAlpha-2A adrenoceptor
Alpha-2A adrenoreceptor
Alpha-2AAR
Alpha-2D adrenergic receptor
DiseaseN/A for non-human GPCRs
Length452
Amino acid sequenceMGSLQPDAGNASWNGTEAPGGGARATPYSLQVTLTLVCLAGLLMLFTVFGNVLVIIAVFTSRALKAPQNLFLVSLASADILVATLVIPFSLANEVMGYWYFGKAWCEIYLALDVLFCTSSIVHLCAISLDRYWSITQAIEYNLKRTPRRIKAIIVTVWVISAVISFPPLISFEKKRGRSGQPSAEPRCEINDQKWYVISSSIGSFFAPCLIMILVYVRIYQIAKRRTRVPPSRRGPDATAAELPGSAERRPNGLGPERGGVGPVGAEVESLQVQLNGAPGEPAPAGAGADALDLEESSSSEHAERPPGSRRSERGPRAKGKARASQVKPGDSLPRRGPGATGLGAPTAGPAEERSGGGAKASRWRGRQNREKRFTFVLAVVIGVFVVCWFPFFFTYTLTAIGCPVPPTLFKFFFWFGYCNSSLNPVIYTIFNHDFRRAFKKILCRGDRKRIV
UniProtQ28838
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4744
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL162510
Molecular formulaC17H25NO2
IUPAC name(4aS,10bR)-10-methoxy-8-methyl-4-propyl-1,2,3,4a,5,10b-hexahydrochromeno[3,4-b]pyridine
Molecular weight275.392
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP3.5
SynonymsBDBM50016891
5-Methoxy-7-methyl-1-propyl-2,3,4,4a,10,10a-hexahydro-1H-9-oxa-1-aza-phenanthrene
Inchi KeyFDJWIXOGARDBHM-UONOGXRCSA-N
Inchi IDInChI=1S/C17H25NO2/c1-4-7-18-8-5-6-13-14(18)11-20-16-10-12(2)9-15(19-3)17(13)16/h9-10,13-14H,4-8,11H2,1-3H3/t13-,14+/m0/s1
PubChem CID14450361
ChEMBLCHEMBL162510
IUPHARN/A
BindingDB50016891
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50504.0 nMPMID2537429BindingDB,ChEMBL

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