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GPCR

NameSomatostatin receptor type 1
SpeciesRattus norvegicus (Rat)
GeneSstr1
SynonymSRIF-2
SS-1-R
SS1-R
SS1R
SST1 receptor
DiseaseN/A for non-human GPCRs
Length391
Amino acid sequenceMFPNGTAPSPTSSPSSSPGGCGEGVCSRGPGSGAADGMEEPGRNSSQNGTLSEGQGSAILISFIYSVVCLVGLCGNSMVIYVILRYAKMKTATNIYILNLAIADELLMLSVPFLVTSTLLRHWPFGALLCRLVLSVDAVNMFTSIYCLTVLSVDRYVAVVHPIKAARYRRPTVAKVVNLGVWVLSLLVILPIVVFSRTAANSDGTVACNMLMPEPAQRWLVGFVLYTFLMGFLLPVGAICLCYVLIIAKMRMVALKAGWQQRKRSERKITLMVMMVVMVFVICWMPFYVVQLVNVFAEQDDATVSQLSVILGYANSCANPILYGFLSDNFKRSFQRILCLSWMDNAAEEPVDYYATALKSRAYSVEDFQPENLESGGVFRNGTCASRISTL
UniProtP28646
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4652
IUPHAR355
DrugBankN/A

Ligand

NameCHEMBL250314
Molecular formulaC26H31F3N4O5S
IUPAC name[2-[4-[(3R,4aR,10aR)-6-methoxy-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinoline-3-carbonyl]piperazin-1-yl]pyridin-3-yl] trifluoromethanesulfonate
Molecular weight568.612
Hydrogen bond acceptor11
Hydrogen bond donor0
XlogP3.8
SynonymsBDBM50423328
Inchi KeyHXSFAPIPSVCGNS-SFHLNBCPSA-N
Inchi IDInChI=1S/C26H31F3N4O5S/c1-31-16-19(13-18-14-20-17(15-21(18)31)5-3-6-22(20)37-2)25(34)33-11-9-32(10-12-33)24-23(7-4-8-30-24)38-39(35,36)26(27,28)29/h3-8,18-19,21H,9-16H2,1-2H3/t18-,19-,21-/m1/s1
PubChem CID44441872
ChEMBLCHEMBL250314
IUPHARN/A
BindingDB50423328
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
Kd562.0 nMPMID17512199BindingDB
Kd562.34 nMPMID17512199ChEMBL

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