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GPCR

Name5-hydroxytryptamine receptor 1B
SpeciesRattus norvegicus (Rat)
GeneHtr1b
SynonymHTR1D2
5-hydroxytryptamine (serotonin) receptor 1B, G protein-coupled
5-HT1Dbeta
5-HT1DB
5-HT1B serotonin receptor
[ Show all ]
DiseaseN/A for non-human GPCRs
Length386
Amino acid sequenceMEEQGIQCAPPPPATSQTGVPLANLSHNCSADDYIYQDSIALPWKVLLVALLALITLATTLSNAFVIATVYRTRKLHTPANYLIASLAVTDLLVSILVMPISTMYTVTGRWTLGQVVCDFWLSSDITCCTASIMHLCVIALDRYWAITDAVDYSAKRTPKRAAIMIVLVWVFSISISLPPFFWRQAKAEEEVLDCFVNTDHVLYTVYSTVGAFYLPTLLLIALYGRIYVEARSRILKQTPNKTGKRLTRAQLITDSPGSTSSVTSINSRVPEVPSESGSPVYVNQVKVRVSDALLEKKKLMAARERKATKTLGIILGAFIVCWLPFFIISLVMPICKDACWFHMAIFDFFNWLGYLNSLINPIIYTMSNEDFKQAFHKLIRFKCTG
UniProtP28564
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3459
IUPHAR2
DrugBankN/A

Ligand

NameCHEMBL279320
Molecular formulaC27H36FN5O3
IUPAC name1-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-3-[2-[4-(6-fluoro-1H-indol-3-yl)piperidin-1-yl]ethyl]urea
Molecular weight497.615
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP3.4
Synonyms1-[3-(2-Dimethylamino-ethoxy)-4-methoxy-phenyl]-3-{2-[4-(6-fluoro-1H-indol-3-yl)-piperidin-1-yl]-ethyl}-urea
BDBM50086106
1-[3-[2-(Dimethylamino)ethoxy]-4-methoxyphenyl]-3-[2-[4-(6-fluoro-1H-indole-3-yl)piperidino]ethyl]urea
Inchi KeyDOWMZCCWUBICMR-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H36FN5O3/c1-32(2)14-15-36-26-17-21(5-7-25(26)35-3)31-27(34)29-10-13-33-11-8-19(9-12-33)23-18-30-24-16-20(28)4-6-22(23)24/h4-7,16-19,30H,8-15H2,1-3H3,(H2,29,31,34)
PubChem CID10696635
ChEMBLCHEMBL279320
IUPHARN/A
BindingDB50086106
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50133.0 nMPMID10737747BindingDB,ChEMBL

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