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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

NameSCHEMBL18547958
Molecular formulaC35H33Cl2N3O3S
IUPAC name5-[bis(4-chlorophenyl)methyl]-2-cyclopropyl-3-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]indazole
Molecular weight646.627
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP8.0
SynonymsBDBM118860
US9682940, 152
Inchi KeyAGJKVMIRCQYVFG-UHFFFAOYSA-N
Inchi IDInChI=1S/C35H33Cl2N3O3S/c1-43-30-13-15-31(16-14-30)44(41,42)39-20-18-25(19-21-39)35-32-22-26(6-17-33(32)38-40(35)29-11-12-29)34(23-2-7-27(36)8-3-23)24-4-9-28(37)10-5-24/h2-10,13-17,22,25,29,34H,11-12,18-21H2,1H3
PubChem CID126617118
ChEMBLN/A
IUPHARN/A
BindingDB118860
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
EC50<10000.0 nMN/ABindingDB

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