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GPCR

Name5-hydroxytryptamine receptor 4
SpeciesHomo sapiens (Human)
GeneHTR4
Synonym5-HT-4
5-hydroxytryptamine (serotonin) receptor 4, G protein-coupled
5-HT4 receptor
5-HT4
serotonin receptor 4
DiseaseN/A
Length388
Amino acid sequenceMDKLDANVSSEEGFGSVEKVVLLTFLSTVILMAILGNLLVMVAVCWDRQLRKIKTNYFIVSLAFADLLVSVLVMPFGAIELVQDIWIYGEVFCLVRTSLDVLLTTASIFHLCCISLDRYYAICCQPLVYRNKMTPLRIALMLGGCWVIPTFISFLPIMQGWNNIGIIDLIEKRKFNQNSNSTYCVFMVNKPYAITCSVVAFYIPFLLMVLAYYRIYVTAKEHAHQIQMLQRAGASSESRPQSADQHSTHRMRTETKAAKTLCIIMGCFCLCWAPFFVTNIVDPFIDYTVPGQVWTAFLWLGYINSGLNPFLYAFLNKSFRRAFLIILCCDDERYRRPSILGQTVPCSTTTINGSTHVLRDAVECGGQWESQCHPPATSPLVAAQPSDT
UniProtQ13639
Protein Data BankN/A
GPCR-HGmod modelQ13639
3D structure modelThis predicted structure model is from GPCR-EXP Q13639.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL1875
IUPHAR9
DrugBankBE0000084

Ligand

NameCHEMBL82833
Molecular formulaC15H21ClN2O2
IUPAC name1-(4-amino-5-chloro-2-methoxyphenyl)-3-piperidin-4-ylpropan-1-one
Molecular weight296.795
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP2.1
SynonymsBHUVUNZKZDLBRF-UHFFFAOYSA-N
SCHEMBL7350324
1-(4-amino-5-chloro-2-methoxyphenyl)-3-(piperidin-4-yl)-propan-1-one
BDBM50213020
1-(4-amino-5-chloro-2-methoxyphenyl)-3-(piperidin-4-yl)propan-1-one
Inchi KeyBHUVUNZKZDLBRF-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H21ClN2O2/c1-20-15-9-13(17)12(16)8-11(15)14(19)3-2-10-4-6-18-7-5-10/h8-10,18H,2-7,17H2,1H3
PubChem CID9882676
ChEMBLCHEMBL82833
IUPHARN/A
BindingDB50213020
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC50125.89 nMBioorg. Med. Chem. Lett., (1994) 4:20:2477ChEMBL
EC50126.0 nMN/ABindingDB
Intrinsic activity0.52 -Bioorg. Med. Chem. Lett., (1994) 4:20:2477ChEMBL

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