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GPCR

NameTrace amine-associated receptor 1
SpeciesHomo sapiens (Human)
GeneTAAR1
Synonymtrace amine receptor 1
TAR1
TaR-1
TA1 receptor
TRAR1
DiseaseN/A
Length339
Amino acid sequenceMMPFCHNIINISCVKNNWSNDVRASLYSLMVLIILTTLVGNLIVIVSISHFKQLHTPTNWLIHSMATVDFLLGCLVMPYSMVRSAEHCWYFGEVFCKIHTSTDIMLSSASIFHLSFISIDRYYAVCDPLRYKAKMNILVICVMIFISWSVPAVFAFGMIFLELNFKGAEEIYYKHVHCRGGCSVFFSKISGVLTFMTSFYIPGSIMLCVYYRIYLIAKEQARLISDANQKLQIGLEMKNGISQSKERKAVKTLGIVMGVFLICWCPFFICTVMDPFLHYIIPPTLNDVLIWFGYLNSTFNPMVYAFFYPWFRKALKMMLFGKIFQKDSSRCKLFLELSS
UniProtQ96RJ0
Protein Data BankN/A
GPCR-HGmod modelQ96RJ0
3D structure modelThis predicted structure model is from GPCR-EXP Q96RJ0.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5857
IUPHAR364
DrugBankBE0001044

Ligand

NameMolPort-000-735-185
Molecular formulaC21H24ClNO3
IUPAC name1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-3-ium-3-yl)propan-1-one;chloride
Molecular weight373.877
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogPNone
SynonymsMCULE-7447934159
Inchi KeyCEIWTDURXPDQPR-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H23NO3.ClH/c23-19(18-5-6-20-21(15-18)25-14-13-24-20)9-12-22-10-7-16-3-1-2-4-17(16)8-11-22;/h1-6,15H,7-14H2;1H
PubChem CID44659123
ChEMBLCHEMBL1325494
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessPartition coefficient log P of this ligand is not available.

Experimental Data

ParameterValueReferenceDatabase source
EC50253.95 nMPubChem BioAssay data setChEMBL
IC50827.75 nMPubChem BioAssay data setChEMBL

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