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GPCR

NameHistamine H2 receptor
SpeciesRattus norvegicus (Rat)
GeneHrh2
Synonymgastric receptor I
H2 receptor
H2R
HH2R
DiseaseN/A for non-human GPCRs
Length358
Amino acid sequenceMEPNGTVHSCCLDSMALKVTISVVLTTLILITIAGNVVVCLAVSLNRRLRSLTNCFIVSLAATDLLLGLLVLPFSAIYQLSFTWSFGHVFCNIYTSLDVMLCTASILNLFMISLDRYCAVTDPLRYPVLVTPVRVAISLVFIWVISITLSFLSIHLGWNSRNGTRGGNDTFKCKVQVNEVYGLVDGLVTFYLPLLIMCVTYYRIFKIAREQAKRINHISSWKAATIREHKATVTLAAVMGAFIICWFPYFTAFVYRGLRGDDAINEAVEGIVLWLGYANSALNPILYAALNRDFRTAYQQLFHCKFASHNSHKTSLRLNNSLLPRSQSREGRWQEEKPLKLQVWSGTELTHPQGNPIR
UniProtP25102
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4654
IUPHAR263
DrugBankN/A

Ligand

NameCHEMBL3248395
Molecular formulaC9H14N6S
IUPAC name1-cyano-3-[2-(1H-imidazol-5-ylmethylsulfanyl)ethyl]-2-methylguanidine
Molecular weight238.313
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP-0.2
SynonymsSCHEMBL10412864
N-cyano-N'-[2-(4imidazolylmethylthio)ethyl]-N"-methylguanidine
PDRYZBRJTTWOME-UHFFFAOYSA-N
N-cyano-N'-[2-(4-imidazolylmethylthio)ethyl]-N"-methylguanidine
Inchi KeyPDRYZBRJTTWOME-UHFFFAOYSA-N
Inchi IDInChI=1S/C9H14N6S/c1-11-9(14-6-10)13-2-3-16-5-8-4-12-7-15-8/h4,7H,2-3,5H2,1H3,(H,12,15)(H2,11,13,14)
PubChem CID54183770
ChEMBLCHEMBL3248395
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Kb1600.0 nMPMID17751ChEMBL

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