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GPCR

NameMelatonin receptor type 1B
SpeciesGallus gallus (Chicken)
Gene
SynonymMel-1B-R
Mel1b receptor
DiseaseN/A for non-human GPCRs
Length289
Amino acid sequenceGNAFVVSLALADLVVALYPYPLVLLAIFHNGWTLGEMHCKVSGFVMGLSVIGSIFNITAIAINRYCYICHSFAYDKVYSCWNTMLYVSLIWVLTVIATVPNFFVGSLKYDPRIYSCTFVQTASSYYTIAVVVIHFIVPITVVSFCYLRIWVLVLQVRRRVKSETKPRLKPSDFRNFLTMFVVFVIFAFCWAPLNFIGLAVAINPSEMAPKVPEWLFIISYFMAYFNSCLNAIIYGLLNQNFRNEYKRILMSLWMPRLFFQDTSKGGTDGQKSKPSPALNNNDQMKTDTL
UniProtP51050
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4466
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL113859
Molecular formulaC15H21NO2
IUPAC nameN-[(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methyl]propanamide
Molecular weight247.338
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP2.7
SynonymsBDBM50072651
N-(7-Methoxy-1,2,3,4-tetrahydro-naphthalen-1-ylmethyl)-propionamide
Inchi KeyIITITOBMRLGGSI-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H21NO2/c1-3-15(17)16-10-12-6-4-5-11-7-8-13(18-2)9-14(11)12/h7-9,12H,3-6,10H2,1-2H3,(H,16,17)
PubChem CID44341203
ChEMBLCHEMBL113859
IUPHARN/A
BindingDB50072651
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki<1000.0 nMPMID9873728BindingDB,ChEMBL
Ki0.45 nMPMID9873728ChEMBL
Ki0.45 nMPMID9873728BindingDB
Ki0.53 nMPMID9873728ChEMBL
Ki0.53 nMPMID9873728BindingDB

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