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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

NameMLS000552453
Molecular formulaC15H18Cl2N4O2S
IUPAC name4-[2-(2,4-dichlorophenoxy)ethylsulfanyl]-6-ethoxy-N,N-dimethyl-1,3,5-triazin-2-amine
Molecular weight389.295
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.9
SynonymsAC1LZ7HI
4-[2-(2,4-dichlorophenoxy)ethylsulfanyl]-6-ethoxy-N,N-dimethyl-1,3,5-triazin-2-amine
SMR000145968
4-{[2-(2,4-dichlorophenoxy)ethyl]sulfanyl}-6-ethoxy-N,N-dimethyl-1,3,5-triazin-2-amine
HMS2539O13
[ Show all ]
Inchi KeyAYTQUIGQFYRMRK-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H18Cl2N4O2S/c1-4-22-14-18-13(21(2)3)19-15(20-14)24-8-7-23-12-6-5-10(16)9-11(12)17/h5-6,9H,4,7-8H2,1-3H3
PubChem CID1894428
ChEMBLCHEMBL1431004
IUPHARN/A
BindingDB42493
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC505537.0 nM, PubChem BioAssay data setBindingDB,ChEMBL

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