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GPCR

Name5-hydroxytryptamine receptor 2A
SpeciesRattus norvegicus (Rat)
GeneHtr2a
Synonymserotonin 5HT-2 receptor
5Ht-2
'D' receptor
5-hydroxytryptamine (serotonin) receptor 2A, G protein-coupled
5-HT2A receptor
[ Show all ]
DiseaseN/A for non-human GPCRs
Length471
Amino acid sequenceMEILCEDNISLSSIPNSLMQLGDGPRLYHNDFNSRDANTSEASNWTIDAENRTNLSCEGYLPPTCLSILHLQEKNWSALLTTVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAIADMLLGFLVMPVSMLTILYGYRWPLPSKLCAIWIYLDVLFSTASIMHLCAISLDRYVAIQNPIHHSRFNSRTKAFLKIIAVWTISVGISMPIPVFGLQDDSKVFKEGSCLLADDNFVLIGSFVAFFIPLTIMVITYFLTIKSLQKEATLCVSDLSTRAKLASFSFLPQSSLSSEKLFQRSIHREPGSYAGRRTMQSISNEQKACKVLGIVFFLFVVMWCPFFITNIMAVICKESCNENVIGALLNVFVWIGYLSSAVNPLVYTLFNKTYRSAFSRYIQCQYKENRKPLQLILVNTIPALAYKSSQLQVGQKKNSQEDAEQTVDDCSMVTLGKQQSEENCTDNIETVNEKVSCV
UniProtP14842
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL322
IUPHAR6
DrugBankN/A

Ligand

Namespiperone
Molecular formulaC23H26FN3O2
IUPAC name8-[4-(4-fluorophenyl)-4-oxobutyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
Molecular weight395.478
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.0
SynonymsLS-154780
36693-EP2371814A1
NCGC00015964-03
8-[4-(4-fluorophenyl)-4-keto-butyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
NCGC00015964-11
[ Show all ]
Inchi KeyDKGZKTPJOSAWFA-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H26FN3O2/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29)
PubChem CID5265
ChEMBLCHEMBL267930
IUPHAR3300, 99
BindingDB21397
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki0.3 nMPMID8524985BindingDB
Ki0.31 nMPMID7582481BindingDB
Ki0.33 nMPMID7908055BindingDB
Ki0.39 nMPMID7984267BindingDB
Ki0.4 nMPMID1347569BindingDB
Ki0.42 nMPMID9225287BindingDB
Ki0.43 nMPMID8301575BindingDB
Ki0.5 nMPMID6645787BindingDB
Ki0.6 nMPMID7984267, PMID9686407BindingDB
Ki0.630957 - 1.0 nMPMID11040033, PMID9655845IUPHAR
Ki1.0 nMPMID9214741BindingDB,ChEMBL
Ki1.04 nMPMID6645787BindingDB
Ki1.24 nMPMID6645787BindingDB
Ki1.6 nMPMID2795135BindingDB
Ki1.8 nMPMID9836624BindingDB,ChEMBL
Ki1.99 nMPMID7984267, PMID10611634BindingDB
Ki3.98 nMPMID7984267BindingDB

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