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GPCR

NameCannabinoid receptor 2
SpeciesHomo sapiens (Human)
GeneCNR2
SynonymPeripheral cannabinoid receptor
rCB2
hCB2
cannabinoid receptor 2 (macrophage)
cannabinoid receptor 2 (spleen)
[ Show all ]
DiseaseImmune disorder
Inflammatory bowel disease
Inflammatory disease
Neuropathic pain
Osteoporosis
[ Show all ]
Length360
Amino acid sequenceMEECWVTEIANGSKDGLDSNPMKDYMILSGPQKTAVAVLCTLLGLLSALENVAVLYLILSSHQLRRKPSYLFIGSLAGADFLASVVFACSFVNFHVFHGVDSKAVFLLKIGSVTMTFTASVGSLLLTAIDRYLCLRYPPSYKALLTRGRALVTLGIMWVLSALVSYLPLMGWTCCPRPCSELFPLIPNDYLLSWLLFIAFLFSGIIYTYGHVLWKAHQHVASLSGHQDRQVPGMARMRLDVRLAKTLGLVLAVLLICWFPVLALMAHSLATTLSDQVKKAFAFCSMLCLINSMVNPVIYALRSGEIRSSAHHCLAHWKKCVRGLGSEAKEEAPRSSVTETEADGKITPWPDSRDLDLSDC
UniProtP34972
Protein Data Bank5zty
GPCR-HGmod modelP34972
3D structure modelThis structure is from PDB ID 5zty.
BioLiPBL0438927
Therapeutic Target DatabaseT37693
ChEMBLCHEMBL253
IUPHAR57
DrugBankBE0000095

Ligand

NameCHEMBL2381791
Molecular formulaC29H36N4O2
IUPAC nameN-(1-adamantyl)-2-(4-methylphenyl)-7-oxo-4-pentylpyrazolo[1,5-a]pyrimidine-6-carboxamide
Molecular weight472.633
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.4
SynonymsN/A
Inchi KeyAFLFDWFMPIVDTL-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H36N4O2/c1-3-4-5-10-32-18-24(27(34)30-29-15-20-11-21(16-29)13-22(12-20)17-29)28(35)33-26(32)14-25(31-33)23-8-6-19(2)7-9-23/h6-9,14,18,20-22H,3-5,10-13,15-17H2,1-2H3,(H,30,34)
PubChem CID71681039
ChEMBLCHEMBL2381791
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
Activity138.0 %PMID23697626ChEMBL
Activity168.0 %PMID23697626ChEMBL
Ki3.41 nMPMID23697626ChEMBL

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