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GPCR

Name5-hydroxytryptamine receptor 2A
SpeciesCanis lupus familiaris (Dog)
GeneHTR2A
Synonym5-HT-2
5-HT-2A
5-hydroxytryptamine receptor
Serotonin receptor 2A
DiseaseN/A for non-human GPCRs
Length470
Amino acid sequenceMDVLFEDNAPLSPTTSSLMPSNGDPRLYGNDLNAGDANTSDAFNWTVDAENRTNLSCEGCLSPPCFSLLHLQEKNWSALLTAVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAIADMLLGFLVMPVSMLTILYGYRWPLPSKLCAVWIYLDVLFSTASIMHLCAISLDRYVAIQNPIHHSRFNSRTKAFLKIIAVWTISVGISMPIPVFGLQDDSKVFKEGSCLLADDNFVLIGSFVSFFIPLTIMVITYFLTIKSLQKEATLCVSDPGTRAKLASFSFLPQSSLSSEKLFQRSIHREPGSYGRRTMQSISNEQKACKVLGIVFFLFVVMWCPFFITNIMAVICKESCNEDIIGALLNVFVWIGYLSSAVNPLVYTLFNKTYRSAFSRYIQCQYKENKKPLQLILVNTIPALAYKSSQLQMGQKKNSKKDAKSTDNDYSMVALGKQHSEDAPTDNINTVNEKVSCV
UniProtO46635
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5781
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL3286560
Molecular formulaC16H19N3O
IUPAC name2-benzyl-4-methoxy-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine
Molecular weight269.348
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.4
SynonymsATZHNYMZPOTUJY-UHFFFAOYSA-N
2-benzyl-4-methoxy-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine
BDBM50019662
SCHEMBL1620484
Inchi KeyATZHNYMZPOTUJY-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H19N3O/c1-20-16-13-7-9-17-10-8-14(13)18-15(19-16)11-12-5-3-2-4-6-12/h2-6,17H,7-11H2,1H3
PubChem CID59312310
ChEMBLCHEMBL3286560
IUPHARN/A
BindingDB50019662
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC50<10000.0 nMPMID24878222BindingDB,ChEMBL
Emax>10.0 %PMID24878222ChEMBL

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