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GPCR

Name5-hydroxytryptamine receptor 1B
SpeciesCricetulus griseus (Chinese hamster)
GeneHTR1B
Synonym5-HT-1B
5-HT1B
Serotonin receptor 1B
DiseaseN/A for non-human GPCRs
Length386
Amino acid sequenceMEEQGIQCAPPPPAASQTGVPLVNLSHNCSAESHIYQDSIALPWKVLLVALLALITLATTLSNAFVIATVYRTRKLHTPANYLIASLAVTDLLVSILVMPVSTMYTVTGRWTLGQVVCDFWLSSDITCCTASIMHLCVIALDRYWAITDAVEYAAKRTPKRAAIMIALVWVFSISISLPPFFWRQAKAEEEVLTCLVNTDHVLYTVYSTGGAFYLPTLLLIALYGRIYVEARSRILKQTPNKTGKRLTRAQLITDSPGSTTSVTSINSRAPDLPSESGSPVYVNQVKVRVSDALLEKKKLMAARERKATKTLGIILGAFIVCWLPFFIISLVMPICKDACWFHMATLDFFNWLGYLNSLINPIIYTMSNEDFKQAFHKLIRFKCAG
UniProtP46636
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3707466
IUPHARN/A
DrugBankN/A

Ligand

NameSCHEMBL931495
Molecular formulaC27H30N6O2S
IUPAC name[7-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]-1-benzofuran-2-yl]-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methanone
Molecular weight502.637
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP3.9
SynonymsUS8859534, 23
CHEMBL3647281
BDBM136337
Inchi KeyHIJXAWSRTHSZGL-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H30N6O2S/c34-26(32-15-17-33(18-16-32)27-29-9-19-36-27)24-20-21-4-3-6-23(25(21)35-24)31-13-11-30(12-14-31)10-7-22-5-1-2-8-28-22/h1-6,8-9,19-20H,7,10-18H2
PubChem CID59636746
ChEMBLCHEMBL3647281
IUPHARN/A
BindingDB136337
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki1.4 nM, NoneBindingDB,ChEMBL

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