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GPCR

NameSomatostatin receptor type 4
SpeciesRattus norvegicus (Rat)
GeneSstr4
SynonymSRIF2B
SS-4-R
SS4-R
SS4R
SST4 receptor
DiseaseN/A for non-human GPCRs
Length384
Amino acid sequenceMNTPATLPLGGEDTTWTPGINASWAPDEEEDAVRSDGTGTAGMVTIQCIYALVCLVGLVGNALVIFVILRYAKMKTATNIYLLNLAVADELFMLSVPFVASAAALRHWPFGAVLCRAVLSVDGLNMFTSVFCLTVLSVDRYVAVVHPLRAATYRRPSVAKLINLGVWLASLLVTLPIAVFADTRPARGGEAVACNLHWPHPAWSAVFVIYTFLLGFLLPVLAIGLCYLLIVGKMRAVALRAGWQQRRRSEKKITRLVLMVVTVFVLCWMPFYVVQLLNLFVTSLDATVNHVSLILSYANSCANPILYGFLSDNFRRSFQRVLCLRCCLLETTGGAEEEPLDYYATALKSRGGPGCICPPLPCQQEPMQAEPACKRVPFTKTTTF
UniProtP30937
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLN/A
IUPHAR358
DrugBankN/A

Ligand

NameBDBM84644
Molecular formulaC44H58N8O6
IUPAC name3-(7-aminoheptyl)-12-(3-aminopropyl)-6-benzyl-9-(1H-indol-3-ylmethyl)-15-(phenylmethoxymethyl)-1,4,7,10,13-pentazacyclopentadecane-2,5,8,11,14-pentone
Molecular weight794.998
Hydrogen bond acceptor8
Hydrogen bond donor8
XlogP3.6
Synonymsc[Aha-Phe-D-Trp-Lys-Ser(Bzl)]
Inchi KeyJUKRARAXIDTJOU-UHFFFAOYSA-N
Inchi IDInChI=1S/C44H58N8O6/c45-23-13-3-1-2-10-21-35-41(54)52-39(29-58-28-31-17-8-5-9-18-31)44(57)49-36(22-14-24-46)40(53)51-38(26-32-27-47-34-20-12-11-19-33(32)34)43(56)50-37(42(55)48-35)25-30-15-6-4-7-16-30/h4-9,11-12,15-20,27,35-39,47H,1-3,10,13-14,21-26,28-29,45-46H2,(H,48,55)(H,49,57)(H,50,56)(H,51,53)(H,52,54)
PubChem CID57339804
ChEMBLN/A
IUPHARN/A
BindingDB84644
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
Ki188.0 nMPMID8102785BindingDB

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