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GPCR

NameGrowth hormone secretagogue receptor type 1
SpeciesRattus norvegicus (Rat)
GeneGhsr
SynonymGH-releasing peptide receptor
Ghrelin receptor
ghrelin receptor 1a
GHRP
GHS-R
[ Show all ]
DiseaseN/A for non-human GPCRs
Length364
Amino acid sequenceMWNATPSEEPEPNVTLDLDWDASPGNDSLPDELLPLFPAPLLAGVTATCVALFVVGISGNLLTMLVVSRFRELRTTTNLYLSSMAFSDLLIFLCMPLDLVRLWQYRPWNFGDLLCKLFQFVSESCTYATVLTITALSVERYFAICFPLRAKVVVTKGRVKLVILVIWAVAFCSAGPIFVLVGVEHENGTDPRDTNECRATEFAVRSGLLTVMVWVSSVFFFLPVFCLTVLYSLIGRKLWRRRGDAAVGASLRDQNHKQTVKMLAVVVFAFILCWLPFHVGRYLFSKSFEPGSLEIAQISQYCNLVSFVLFYLSAAINPILYNIMSKKYRVAVFKLLGFESFSQRKLSTLKDESSRAWTKSSINT
UniProtO08725
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3278
IUPHAR246
DrugBankN/A

Ligand

NameCHEMBL331303
Molecular formulaC36H47FN4O4
IUPAC name(E)-5-amino-N-[(2R)-1-[[(2R)-3-(4-fluorophenyl)-1-[[(2R)-2-hydroxypropyl]amino]-1-oxopropan-2-yl]-methylamino]-1-oxo-3-(4-phenylcyclohexa-1,5-dien-1-yl)propan-2-yl]-N,5-dimethylhex-2-enamide
Molecular weight618.794
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP4.1
SynonymsBDBM50066814
(E)-5-Amino-5-methyl-hex-2-enoic acid [(R)-1-{[(R)-2-(4-fluoro-phenyl)-1-((R)-2-hydroxy-propylcarbamoyl)-ethyl]-methyl-carbamoyl}-2-(4-phenyl-cyclohexa-1,5-dienyl)-ethyl]-methyl-amide
Inchi KeyORUIITFKECREJK-YBTUSNJDSA-N
Inchi IDInChI=1S/C36H47FN4O4/c1-25(42)24-39-34(44)31(22-27-15-19-30(37)20-16-27)41(5)35(45)32(40(4)33(43)12-9-21-36(2,3)38)23-26-13-17-29(18-14-26)28-10-7-6-8-11-28/h6-17,19-20,25,29,31-32,42H,18,21-24,38H2,1-5H3,(H,39,44)/b12-9+/t25-,29?,31-,32-/m1/s1
PubChem CID44348031
ChEMBLCHEMBL331303
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC506.0 nMPMID9733496ChEMBL
Emax90.0 %PMID9733496ChEMBL

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