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GPCR

Name5-hydroxytryptamine receptor 1A
SpeciesRattus norvegicus (Rat)
GeneHtr1a
Synonym5-HT1A receptor
5-hydroxytryptamine (serotonin) receptor 1A, G protein-coupled
5-HT1A
ADRB2RL1
ADRBRL1
[ Show all ]
DiseaseN/A for non-human GPCRs
Length422
Amino acid sequenceMDVFSFGQGNNTTASQEPFGTGGNVTSISDVTFSYQVITSLLLGTLIFCAVLGNACVVAAIALERSLQNVANYLIGSLAVTDLMVSVLVLPMAALYQVLNKWTLGQVTCDLFIALDVLCCTSSILHLCAIALDRYWAITDPIDYVNKRTPRRAAALISLTWLIGFLISIPPMLGWRTPEDRSDPDACTISKDHGYTIYSTFGAFYIPLLLMLVLYGRIFRAARFRIRKTVRKVEKKGAGTSLGTSSAPPPKKSLNGQPGSGDWRRCAENRAVGTPCTNGAVRQGDDEATLEVIEVHRVGNSKEHLPLPSESGSNSYAPACLERKNERNAEAKRKMALARERKTVKTLGIIMGTFILCWLPFFIVALVLPFCESSCHMPALLGAIINWLGYSNSLLNPVIYAYFNKDFQNAFKKIIKCKFCRR
UniProtP19327
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL273
IUPHAR1
DrugBankN/A

Ligand

NameCHEMBL26998
Molecular formulaC16H25NO
IUPAC name(7R)-7-(dipropylamino)-5,6,7,8-tetrahydronaphthalen-1-ol
Molecular weight247.382
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP4.1
Synonyms(R)-7-Dipropylamino-5,6,7,8-tetrahydro-naphthalen-1-ol
80300-09-0
LS-177548
PDSP2_001693
BDBM50016777
[ Show all ]
Inchi KeyASXGJMSKWNBENU-CQSZACIVSA-N
Inchi IDInChI=1S/C16H25NO/c1-3-10-17(11-4-2)14-9-8-13-6-5-7-16(18)15(13)12-14/h5-7,14,18H,3-4,8-12H2,1-2H3/t14-/m1/s1
PubChem CID6603866
ChEMBLCHEMBL26998
IUPHARN/A
BindingDB50016777
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Hill coefficient0.97 -Bioorg. Med. Chem. Lett., (1991) 1:5:257ChEMBL
IC504.84 nMPMID2522991BindingDB,ChEMBL
Inhibition41.0 %PMID8831769ChEMBL
Inhibition43.0 %PMID8831769ChEMBL
Inhibition45.0 %PMID8831769ChEMBL
Inhibition47.0 %PMID8831769ChEMBL
Inhibition53.0 %PMID8831769ChEMBL
Ki1.3 nM, PMID7506312, Bioorg. Med. Chem. Lett., (1991) 1:5:257, PMID8831769BindingDB,ChEMBL
Ki3.1 nMPMID8340910BindingDB,ChEMBL
Ki4.1 nMPMID7530773BindingDB,ChEMBL
No. of rats42.0 -PMID7506312ChEMBL
Turnover66.0 -PMID7506312ChEMBL

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