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GPCR

Name5-hydroxytryptamine receptor 1E
SpeciesHomo sapiens (Human)
GeneHTR1E
Synonym5-hydroxytryptamine (serotonin) receptor 1E, G protein-coupled
5-HT1Ealpha
5-ht1e receptor
5-HT1E
5-HT-1E
[ Show all ]
DiseaseN/A
Length365
Amino acid sequenceMNITNCTTEASMAIRPKTITEKMLICMTLVVITTLTTLLNLAVIMAIGTTKKLHQPANYLICSLAVTDLLVAVLVMPLSIIYIVMDRWKLGYFLCEVWLSVDMTCCTCSILHLCVIALDRYWAITNAIEYARKRTAKRAALMILTVWTISIFISMPPLFWRSHRRLSPPPSQCTIQHDHVIYTIYSTLGAFYIPLTLILILYYRIYHAAKSLYQKRGSSRHLSNRSTDSQNSFASCKLTQTFCVSDFSTSDPTTEFEKFHASIRIPPFDNDLDHPGERQQISSTRERKAARILGLILGAFILSWLPFFIKELIVGLSIYTVSSEVADFLTWLGYVNSLINPLLYTSFNEDFKLAFKKLIRCREHT
UniProtP28566
Protein Data BankN/A
GPCR-HGmod modelP28566
3D structure modelThis predicted structure model is from GPCR-EXP P28566.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2182
IUPHAR4
DrugBankBE0000476

Ligand

NameCHEMBL2432053
Molecular formulaC19H22N2O
IUPAC name(11S)-11-[methyl(2-pyridin-2-ylethyl)amino]pentacyclo[5.4.0.02,6.03,10.05,9]undecan-8-one
Molecular weight294.398
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP2.0
SynonymsN/A
Inchi KeyDEOOAAFCKARVDM-CAUKCHDASA-N
Inchi IDInChI=1S/C19H22N2O/c1-21(7-5-9-4-2-3-6-20-9)18-14-10-8-11-13-12(10)16(18)17(13)19(22)15(11)14/h2-4,6,10-18H,5,7-8H2,1H3/t10?,11?,12?,13?,14?,15?,16?,17?,18-/m0/s1
PubChem CID73346335
ChEMBLCHEMBL2432053
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
Inhibition>50.0 %PMID23981939ChEMBL

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