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GPCR

NameOlfactory receptor 5K1
SpeciesHomo sapiens (Human)
GeneOR5K1
SynonymHTPCRX10
Olfactory receptor OR3-8
DiseaseN/A
Length308
Amino acid sequenceMAEENHTMKNEFILTGFTDHPELKTLLFVVFFAIYLITVVGNISLVALIFTHRRLHTPMYIFLGNLALVDSCCACAITPKMLENFFSENKRISLYECAVQFYFLCTVETADCFLLAAMAYDRYVAICNPLQYHIMMSKKLCIQMTTGAFIAGNLHSMIHVGLVFRLVFCGSNHINHFYCDILPLYRLSCVDPYINELVLFIFSGSVQVFTIGSVLISYLYILLTIFKMKSKEGRAKAFSTCASHFLSVSLFYGSLFFMYVRPNLLEEGDKDIPAAILFTIVVPLLNPFIYSLRNREVISVLRKILMKK
UniProtQ8NHB7
Protein Data BankN/A
GPCR-HGmod modelQ8NHB7
3D structure modelThis predicted structure model is from GPCR-EXP Q8NHB7.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3721312
IUPHARN/A
DrugBankN/A

Ligand

NameDamascenone
Molecular formulaC13H18O
IUPAC name(E)-1-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one
Molecular weight190.286
Hydrogen bond acceptor1
Hydrogen bond donor0
XlogP3.2
Synonyms.beta.-Damascenone
2-Buten-1-one, 1-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-, (2E)-
4-(2,6,6-Trimethylcyclohexa-1,3-dienyl)but-2-en-4-one
beta -damascenone
DSSTox_CID_21397
[ Show all ]
Inchi KeyPOIARNZEYGURDG-FNORWQNLSA-N
Inchi IDInChI=1S/C13H18O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8H,9H2,1-4H3/b7-5+
PubChem CID5366074
ChEMBLCHEMBL3733030
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Inhibition40.0 %NoneChEMBL

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