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GPCR

Name5-hydroxytryptamine receptor 5A
SpeciesHomo sapiens (Human)
GeneHTR5A
Synonym5-HT5alpha
5-HT-5
MR22
Htr5
5-HT-5A
[ Show all ]
DiseaseN/A
Length357
Amino acid sequenceMDLPVNLTSFSLSTPSPLETNHSLGKDDLRPSSPLLSVFGVLILTLLGFLVAATFAWNLLVLATILRVRTFHRVPHNLVASMAVSDVLVAALVMPLSLVHELSGRRWQLGRRLCQLWIACDVLCCTASIWNVTAIALDRYWSITRHMEYTLRTRKCVSNVMIALTWALSAVISLAPLLFGWGETYSEGSEECQVSREPSYAVFSTVGAFYLPLCVVLFVYWKIYKAAKFRVGSRKTNSVSPISEAVEVKDSAKQPQMVFTVRHATVTFQPEGDTWREQKEQRAALMVGILIGVFVLCWIPFFLTELISPLCSCDIPAIWKSIFLWLGYSNSFFNPLIYTAFNKNYNSAFKNFFSRQH
UniProtP47898
Protein Data BankN/A
GPCR-HGmod modelP47898
3D structure modelThis predicted structure model is from GPCR-EXP P47898.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3426
IUPHAR10
DrugBankBE0004688

Ligand

Name1103458-91-8
Molecular formulaC29H30N6O3
IUPAC name4-(6-methoxypyridin-3-yl)-N-[2-methyl-3-[(6-oxo-4-piperazin-1-ylpyridazin-1-yl)methyl]phenyl]benzamide
Molecular weight510.598
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP2.7
SynonymsBenzamide,4-(6-methoxy-3-pyridinyl)-N-[2-methyl-3-[[6-oxo-4-(1-piperazinyl)-1(6H)-pyridazinyl]methyl]phenyl]-
4-(6-Methoxypyridin-3-yl)-N-(2-methyl-3-((6-oxo-4-(piperazin-1-yl)pyridazin-1(6H)-yl)methyl)phenyl)benzamide
KB-74940
BDBM50412987
ZINC40917971
[ Show all ]
Inchi KeyIFWGJAXMPXZADJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H30N6O3/c1-20-24(19-35-28(36)16-25(18-32-35)34-14-12-30-13-15-34)4-3-5-26(20)33-29(37)22-8-6-21(7-9-22)23-10-11-27(38-2)31-17-23/h3-11,16-18,30H,12-15,19H2,1-2H3,(H,33,37)
PubChem CID25209705
ChEMBLCHEMBL475965
IUPHARN/A
BindingDB50412987
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
Inhibition30.0 %PMID19146417ChEMBL

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