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GPCR

Name5-hydroxytryptamine receptor 6
SpeciesHomo sapiens (Human)
GeneHTR6
Synonym5-HT6 receptor
5-hydroxytryptamine (serotonin) receptor 6, G protein-coupled
5-HT-6
serotonin receptor 6
ST-B17
[ Show all ]
DiseaseSchizophrenia
Obesity
Neurological disease
Neurodegenerative disease
Emesis
[ Show all ]
Length440
Amino acid sequenceMVPEPGPTANSTPAWGAGPPSAPGGSGWVAAALCVVIALTAAANSLLIALICTQPALRNTSNFFLVSLFTSDLMVGLVVMPPAMLNALYGRWVLARGLCLLWTAFDVMCCSASILNLCLISLDRYLLILSPLRYKLRMTPLRALALVLGAWSLAALASFLPLLLGWHELGHARPPVPGQCRLLASLPFVLVASGLTFFLPSGAICFTYCRILLAARKQAVQVASLTTGMASQASETLQVPRTPRPGVESADSRRLATKHSRKALKASLTLGILLGMFFVTWLPFFVANIVQAVCDCISPGLFDVLTWLGYCNSTMNPIIYPLFMRDFKRALGRFLPCPRCPRERQASLASPSLRTSHSGPRPGLSLQQVLPLPLPPDSDSDSDAGSGGSSGLRLTAQLLLPGEATQDPPLPTRAAAAVNFFNIDPAEPELRPHPLGIPTN
UniProtP50406
Protein Data BankN/A
GPCR-HGmod modelP50406
3D structure modelThis predicted structure model is from GPCR-EXP P50406.
BioLiPN/A
Therapeutic Target DatabaseT16691
ChEMBLCHEMBL3371
IUPHAR11
DrugBankBE0000945

Ligand

NameCHEMBL3692841
Molecular formulaC17H15NO3S
IUPAC name8-(benzenesulfonyl)-1,2,3,4-tetrahydro-[1]benzofuro[3,2-c]pyridine
Molecular weight313.371
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.6
Synonyms8-(Phenylsulfonyl)-1,2,3,4-tetrahydrobenzofuro[3,2-c]pyridine
US9067949, 28
AGJMBLMVRSXPOC-UHFFFAOYSA-N
BDBM166171
SCHEMBL10322900
Inchi KeyAGJMBLMVRSXPOC-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H15NO3S/c19-22(20,12-4-2-1-3-5-12)13-6-7-16-14(10-13)15-11-18-9-8-17(15)21-16/h1-7,10,18H,8-9,11H2
PubChem CID57414390
ChEMBLCHEMBL3692841
IUPHARN/A
BindingDB166171
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki19.0 nM, NoneBindingDB,ChEMBL

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