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GPCR

NameHistamine H3 receptor
SpeciesRattus norvegicus (Rat)
GeneHrh3
SynonymGPCR97
H3 receptor
H3R
HH3R
DiseaseN/A for non-human GPCRs
Length445
Amino acid sequenceMERAPPDGLMNASGTLAGEAAAAGGARGFSAAWTAVLAALMALLIVATVLGNALVMLAFVADSSLRTQNNFFLLNLAISDFLVGAFCIPLYVPYVLTGRWTFGRGLCKLWLVVDYLLCASSVFNIVLISYDRFLSVTRAVSYRAQQGDTRRAVRKMALVWVLAFLLYGPAILSWEYLSGGSSIPEGHCYAEFFYNWYFLITASTLEFFTPFLSVTFFNLSIYLNIQRRTRLRLDGGREAGPEPPPDAQPSPPPAPPSCWGCWPKGHGEAMPLHRYGVGEAGPGVEAGEAALGGGSGGGAAASPTSSSGSSSRGTERPRSLKRGSKPSASSASLEKRMKMVSQSITQRFRLSRDKKVAKSLAIIVSIFGLCWAPYTLLMIIRAACHGRCIPDYWYETSFWLLWANSAVNPVLYPLCHYSFRRAFTKLLCPQKLKVQPHGSLEQCWK
UniProtQ9QYN8
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4124
IUPHAR264
DrugBankN/A

Ligand

NameCHEMBL128585
Molecular formulaC17H21N3O2
IUPAC name3-(1H-imidazol-5-yl)propyl N-[cyclopropyl(phenyl)methyl]carbamate
Molecular weight299.374
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.7
SynonymsBDBM50118162
(Cyclopropyl-phenyl-methyl)-carbamic acid 3-(1H-imidazol-4-yl)-propyl ester;0.8C2H2O4
Inchi KeyAISUIUPQHGHDCK-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H21N3O2/c21-17(22-10-4-7-15-11-18-12-19-15)20-16(14-8-9-14)13-5-2-1-3-6-13/h1-3,5-6,11-12,14,16H,4,7-10H2,(H,18,19)(H,20,21)
PubChem CID11748564
ChEMBLCHEMBL128585
IUPHARN/A
BindingDB50118162
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki39.81 nMPMID12190321ChEMBL
Ki44.0 nMPMID12190321BindingDB,ChEMBL

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