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GPCR

NameHistamine H1 receptor
SpeciesCavia porcellus (Guinea pig)
GeneHRH1
SynonymH1R
HH1R
DiseaseN/A for non-human GPCRs
Length488
Amino acid sequenceMSFLPGMTPVTLSNFSWALEDRMLEGNSTTTPTRQLMPLVVVLSSVSLVTVALNLLVLYAVRSERKLHTVGNLYIVSLSVADLIVGAVVMPMSILYLHRSAWILGRPLCLFWLSMDYVASTASIFSVFILCIDRYRSVQQPLRYLRYRTKTRASATILGAWLLSFLWVIPILGWHHFMAPTSEPREKKCETDFYDVTWFKVMTAIINFYLPTLLMLWFYIRIYKAVRRHCQHRQLINSSLPSFSEMKLKLENAKVDTRRMGKESPWEDPKRCSKDASGVHTPMPSSQHLVDMPCAAVLSEDEGGEVGTRQMPMLAVGDGRCCEALNHMHSQLELSGQSRATHSISARPEEWTVVDGQSFPITDSDTSTEAAPMGGQPRSGSNSGLDYIKFTWRRLRSHSRQYTSGLHLNRERKAAKQLGCIMAAFILCWIPYFVFFMVIAFCKSCSNEPVHMFTIWLGYLNSTLNPLIYPLCNENFRKTFKRILRIPP
UniProtP31389
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3943
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL356449
Molecular formulaC27H30N4
IUPAC nameN-[2-[2-(3,3-diphenylpropyl)-1H-imidazol-5-yl]ethyl]-2-pyridin-3-ylethanamine
Molecular weight410.565
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.9
SynonymsBDBM50409768
Inchi KeyBYIKGUJPJAOQIC-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H30N4/c1-3-9-23(10-4-1)26(24-11-5-2-6-12-24)13-14-27-30-21-25(31-27)16-19-28-18-15-22-8-7-17-29-20-22/h1-12,17,20-21,26,28H,13-16,18-19H2,(H,30,31)
PubChem CID11269875
ChEMBLCHEMBL356449
IUPHARN/A
BindingDB50409768
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Concentration10.0 uMPMID14640554ChEMBL
EC5077.62 nMPMID14640554ChEMBL
EC5083.18 nMPMID14640554ChEMBL
Emax64.0 %PMID14640554ChEMBL
Emax73.0 %PMID14640554ChEMBL
Kd3.236 nMPMID14640554ChEMBL
Kd3.24 nMPMID14640554BindingDB
pKp6.52 -PMID14640554ChEMBL
Relative potency195.0 -PMID14640554ChEMBL
Relative potency254.0 -PMID14640554ChEMBL

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