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GPCR

NameCannabinoid receptor 1
SpeciesMus musculus (Mouse)
GeneCnr1
SynonymSKR6R
Neuronal cannabinoid receptor
Central cannabinoid receptor
CB1R
CB1 receptor
[ Show all ]
DiseaseN/A for non-human GPCRs
Length473
Amino acid sequenceMKSILDGLADTTFRTITTDLLYVGSNDIQYEDIKGDMASKLGYFPQKFPLTSFRGSPFQEKMTAGDNSPLVPAGDTTNITEFYNKSLSSFKENEDNIQCGENFMDMECFMILNPSQQLAIAVLSLTLGTFTVLENLLVLCVILHSRSLRCRPSYHFIGSLAVADLLGSVIFVYSFVDFHVFHRKDSPNVFLFKLGGVTASFTASVGSLFLTAIDRYISIHRPLAYKRIVTRPKAVVAFCLMWTIAIVIAVLPLLGWNCKKLQSVCSDIFPLIDETYLMFWIGVTSVLLLFIVYAYMYILWKAHSHAVRMIQRGTQKSIIIHTSEDGKVQVTRPDQARMDIRLAKTLVLILVVLIICWGPLLAIMVYDVFGKMNKLIKTVFAFCSMLCLLNSTVNPIIYALRSKDLRHAFRSMFPSCEGTAQPLDNSMGDSDCLHKHANNTASMHRAAESCIKSTVKIAKVTMSVSTDTSAEAL
UniProtP47746
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3037
IUPHAR56
DrugBankN/A

Ligand

NameCHEMBL217583
Molecular formulaC22H21ClFN3O2
IUPAC name7-chloro-N-cyclohexyl-1-[(4-fluorophenyl)methyl]-4-oxo-1,8-naphthyridine-3-carboxamide
Molecular weight413.877
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.8
SynonymsBDBM50195515
N-cyclohexyl-7-chloro-1-(p-fluorbenzyl)-1,8-naphthyridin-4(1H)-on-3-carboxamide
Inchi KeyDQKYSIYORZUPAL-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H21ClFN3O2/c23-19-11-10-17-20(28)18(22(29)25-16-4-2-1-3-5-16)13-27(21(17)26-19)12-14-6-8-15(24)9-7-14/h6-11,13,16H,1-5,12H2,(H,25,29)
PubChem CID16086907
ChEMBLCHEMBL217583
IUPHARN/A
BindingDB50195515
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki495.0 nMPMID17004710BindingDB,ChEMBL

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