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GPCR

NameNeuropeptide Y receptor type 1
SpeciesHomo sapiens (Human)
GeneNPY1R
Synonymneuropeptide Y receptor type 1
NPY-Y1 receptor
NPY1-R
FC5
Y1 receptor
[ Show all ]
DiseaseHypertension; Obesity; Heart disease
Obesity
Eating disorders reduction in food intake obesity anxiety
Eating disorders reduction in food intake
Eating disorder
[ Show all ]
Length384
Amino acid sequenceMNSTLFSQVENHSVHSNFSEKNAQLLAFENDDCHLPLAMIFTLALAYGAVIILGVSGNLALIIIILKQKEMRNVTNILIVNLSFSDLLVAIMCLPFTFVYTLMDHWVFGEAMCKLNPFVQCVSITVSIFSLVLIAVERHQLIINPRGWRPNNRHAYVGIAVIWVLAVASSLPFLIYQVMTDEPFQNVTLDAYKDKYVCFDQFPSDSHRLSYTTLLLVLQYFGPLCFIFICYFKIYIRLKRRNNMMDKMRDNKYRSSETKRINIMLLSIVVAFAVCWLPLTIFNTVFDWNHQIIATCNHNLLFLLCHLTAMISTCVNPIFYGFLNKNFQRDLQFFFNFCDFRSRDDDYETIAMSTMHTDVSKTSLKQASPVAFKKINNNDDNEKI
UniProtP25929
Protein Data Bank5zbh
GPCR-HGmod modelP25929
3D structure modelThis structure is from PDB ID 5zbh.
BioLiPBL0411971
Therapeutic Target DatabaseT89213
ChEMBLCHEMBL4777
IUPHAR305
DrugBankN/A

Ligand

NameCHEMBL144262
Molecular formulaC24H29BrN2OS
IUPAC name1-[2-[2-[(4-bromophenoxy)methyl]-1-benzothiophen-3-yl]ethyl]-N,N-dimethylpiperidin-4-amine
Molecular weight473.473
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP6.0
SynonymsBDBM50075261
(1-{2-[2-(4-Bromo-phenoxymethyl)-benzo[b]thiophen-3-yl]-ethyl}-piperidin-4-yl)-dimethyl-amine
Inchi KeyBTWNZYQCFVVOLW-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H29BrN2OS/c1-26(2)19-11-14-27(15-12-19)16-13-22-21-5-3-4-6-23(21)29-24(22)17-28-20-9-7-18(25)8-10-20/h3-10,19H,11-17H2,1-2H3
PubChem CID44362801
ChEMBLCHEMBL144262
IUPHARN/A
BindingDB50075261
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki160.0 nMPMID10091705BindingDB,ChEMBL

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