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GPCR

Name5-hydroxytryptamine receptor 1D
SpeciesHomo sapiens (Human)
GeneHTR1D
SynonymSerotonin 1D alpha receptor
serotonin receptor 1D
HTRL
Htr1db
5-HT-1D
[ Show all ]
DiseaseAcute migraine
Epilepsy
Migraine headaches
Mood disorder
Migraine
[ Show all ]
Length377
Amino acid sequenceMSPLNQSAEGLPQEASNRSLNATETSEAWDPRTLQALKISLAVVLSVITLATVLSNAFVLTTILLTRKLHTPANYLIGSLATTDLLVSILVMPISIAYTITHTWNFGQILCDIWLSSDITCCTASILHLCVIALDRYWAITDALEYSKRRTAGHAATMIAIVWAISICISIPPLFWRQAKAQEEMSDCLVNTSQISYTIYSTCGAFYIPSVLLIILYGRIYRAARNRILNPPSLYGKRFTTAHLITGSAGSSLCSLNSSLHEGHSHSAGSPLFFNHVKIKLADSALERKRISAARERKATKILGIILGAFIICWLPFFVVSLVLPICRDSCWIHPALFDFFTWLGYLNSLINPIIYTVFNEEFRQAFQKIVPFRKAS
UniProtP28221
Protein Data BankN/A
GPCR-HGmod modelP28221
3D structure modelThis predicted structure model is from GPCR-EXP P28221.
BioLiPN/A
Therapeutic Target DatabaseT11072
ChEMBLCHEMBL1983
IUPHAR3
DrugBankBE0000659

Ligand

Nametryptamine
Molecular formulaC10H12N2
IUPAC name2-(1H-indol-3-yl)ethanamine
Molecular weight160.22
Hydrogen bond acceptor1
Hydrogen bond donor2
XlogP1.6
Synonyms(3-Indolyl)ethylamine
(Amino-2 ethyl)-3 indole
(Amino-2 ethyl)-3 indole [French]
.beta.-(3-Indolyl)ethylamine
005T661
[ Show all ]
Inchi KeyAPJYDQYYACXCRM-UHFFFAOYSA-N
Inchi IDInChI=1S/C10H12N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6,11H2
PubChem CID1150
ChEMBLCHEMBL6640
IUPHAR125
BindingDB50024210
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Intrinsic activity0.86 -PMID7658443ChEMBL
Ki23.0 nMPMID8568822BindingDB,ChEMBL
Ki39.8107 - 158.489 nMPMID1565658, PMID8967979IUPHAR
Ki41.7 nMWaeber et al., PMID1988PDSP
Ki46.0 nMPeroutka et al., PMID1989PDSP
Ki61.0 nMPMID8568822BindingDB,ChEMBL
Ki85.11 nMPMID7984267PDSP,BindingDB
Ki521.0 nMPMID1565658PDSP,BindingDB
p[A50]6.9 -PMID7658443ChEMBL
Selectivity1.7 -PMID8568822ChEMBL

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