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GPCR

NameHistamine H4 receptor
SpeciesHomo sapiens (Human)
GeneHRH4
SynonymPfi-013
SP9144
HH4R
H4R
H4 receptor
[ Show all ]
DiseaseAllergic rhinitis
Asthma
Inflammatory disease
Rheumatoid arthritis
Length390
Amino acid sequenceMPDTNSTINLSLSTRVTLAFFMSLVAFAIMLGNALVILAFVVDKNLRHRSSYFFLNLAISDFFVGVISIPLYIPHTLFEWDFGKEICVFWLTTDYLLCTASVYNIVLISYDRYLSVSNAVSYRTQHTGVLKIVTLMVAVWVLAFLVNGPMILVSESWKDEGSECEPGFFSEWYILAITSFLEFVIPVILVAYFNMNIYWSLWKRDHLSRCQSHPGLTAVSSNICGHSFRGRLSSRRSLSASTEVPASFHSERQRRKSSLMFSSRTKMNSNTIASKMGSFSQSDSVALHQREHVELLRARRLAKSLAILLGVFAVCWAPYSLFTIVLSFYSSATGPKSVWYRIAFWLQWFNSFVNPLLYPLCHKRFQKAFLKIFCIKKQPLPSQHSRSVSS
UniProtQ9H3N8
Protein Data BankN/A
GPCR-HGmod modelQ9H3N8
3D structure modelThis predicted structure model is from GPCR-EXP Q9H3N8.
BioLiPN/A
Therapeutic Target DatabaseT26500
ChEMBLCHEMBL3759
IUPHAR265
DrugBankBE0000146

Ligand

NameSCHEMBL602163
Molecular formulaC26H35ClN4O
IUPAC name1-[3-[4-(6-tert-butyl-1H-benzimidazol-2-yl)-2-chlorophenoxy]propyl]-N,N-dimethylpyrrolidin-3-amine
Molecular weight455.043
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.0
Synonyms1-{3-[4-(5-tert-butyl-1H-1,3-benzodiazol-2-yl)-2-chlorophenoxy]propyl}-N,N-dimethylpyrrolidin-3-amine
BDBM22559
2-arylbenzimidazole derivative, 5
CHEMBL376268
Inchi KeyAADBANJKFIORNE-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H35ClN4O/c1-26(2,3)19-8-9-22-23(16-19)29-25(28-22)18-7-10-24(21(27)15-18)32-14-6-12-31-13-11-20(17-31)30(4)5/h7-10,15-16,20H,6,11-14,17H2,1-5H3,(H,28,29)
PubChem CID11751419
ChEMBLCHEMBL376268
IUPHARN/A
BindingDB22559
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki250.0 nMPMID16990005, PMID20452213BindingDB,ChEMBL

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