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GPCR

NameBeta-1 adrenergic receptor
SpeciesRattus norvegicus (Rat)
GeneAdrb1
Synonymadrenergic receptor
beta1-adrenoceptor
Beta-1 adrenoreceptor
Beta-1 adrenoceptor
beta-1 adrenergic receptor
[ Show all ]
DiseaseN/A for non-human GPCRs
Length466
Amino acid sequenceMGAGALALGASEPCNLSSAAPLPDGAATAARLLVLASPPASLLPPASEGSAPLSQQWTAGMGLLLALIVLLIVVGNVLVIVAIAKTPRLQTLTNLFIMSLASADLVMGLLVVPFGATIVVWGRWEYGSFFCELWTSVDVLCVTASIETLCVIALDRYLAITLPFRYQSLLTRARARALVCTVWAISALVSFLPILMHWWRAESDEARRCYNDPKCCDFVTNRAYAIASSVVSFYVPLCIMAFVYLRVFREAQKQVKKIDSCERRFLTGPPRPPSPAPSPSPGPPRPADSLANGRSSKRRPSRLVALREQKALKTLGIIMGVFTLCWLPFFLANVVKAFHRDLVPDRLFVFFNWLGYANSAFNPIIYCRSPDFRKAFQRLLCCARRAACRRRAAHGDRPRASGCLARAGPPPSPGAPSDDDDDDAGATPPARLLEPWAGCNGGTTTVDSDSSLDEPGRQGFSSESKV
UniProtP18090
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3252
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL2375998
Molecular formulaC17H25NO5
IUPAC name6-[2-hydroxy-3-(propylamino)propoxy]-7-methoxy-3-methyl-1H-isochromen-4-one
Molecular weight323.389
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP1.3
SynonymsN/A
Inchi KeyGKHHKFJDVKAZHS-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H25NO5/c1-4-5-18-8-13(19)10-23-16-7-14-12(6-15(16)21-3)9-22-11(2)17(14)20/h6-7,11,13,18-19H,4-5,8-10H2,1-3H3
PubChem CID71602787
ChEMBLCHEMBL2375998
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Inhibition41.9 %PMID23538234ChEMBL
Inhibition51.9 %PMID23538234ChEMBL

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