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GPCR

NameG-protein coupled receptor 52
SpeciesHomo sapiens (Human)
GeneGPR52
SynonymGPR52
DiseaseN/A
Length361
Amino acid sequenceMNESRWTEWRILNMSSGIVNVSERHSCPLGFGHYSVVDVCIFETVVIVLLTFLIIAGNLTVIFVFHCAPLLHHYTTSYFIQTMAYADLFVGVSCLVPTLSLLHYSTGVHESLTCQVFGYIISVLKSVSMACLACISVDRYLAITKPLSYNQLVTPCRLRICIILIWIYSCLIFLPSFFGWGKPGYHGDIFEWCATSWLTSAYFTGFIVCLLYAPAAFVVCFTYFHIFKICRQHTKEINDRRARFPSHEVDSSRETGHSPDRRYAMVLFRITSVFYMLWLPYIIYFLLESSRVLDNPTLSFLTTWLAISNSFCNCVIYSLSNSVFRLGLRRLSETMCTSCMCVKDQEAQEPKPRKRANSCSI
UniProtQ9Y2T5
Protein Data BankN/A
GPCR-HGmod modelQ9Y2T5
3D structure modelThis predicted structure model is from GPCR-EXP Q9Y2T5.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3297639
IUPHAR108
DrugBankN/A

Ligand

NameCHEMBL3298233
Molecular formulaC25H21ClFNO2S
IUPAC name3-[2-[(3-chloro-5-fluorophenyl)methyl]-1-benzothiophen-7-yl]-N-(2-methoxyethyl)benzamide
Molecular weight453.956
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.4
Synonyms3-[2-(3-Chloro-5-fluorobenzyl)-1-benzothiophen-7-yl]-N-(2-methoxyethyl)benzamide
YNXYTOJEFCKHEM-UHFFFAOYSA-N
BDBM50022190
SCHEMBL3198777
Inchi KeyYNXYTOJEFCKHEM-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H21ClFNO2S/c1-30-9-8-28-25(29)19-6-2-4-17(13-19)23-7-3-5-18-14-22(31-24(18)23)12-16-10-20(26)15-21(27)11-16/h2-7,10-11,13-15H,8-9,12H2,1H3,(H,28,29)
PubChem CID59193920
ChEMBLCHEMBL3298233
IUPHARN/A
BindingDB50022190
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
EC5029.51 nMPMID24884590ChEMBL
EC5030.0 nMPMID24884590BindingDB
Emax79.8 %PMID24884590ChEMBL

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