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GPCR

NameMuscarinic acetylcholine receptor M4
SpeciesRattus norvegicus (Rat)
GeneChrm4
Synonymcholinergic receptor
cholinergic receptor, muscarinic 4
Chrm-4
HM3
M4 receptor
DiseaseN/A for non-human GPCRs
Length478
Amino acid sequenceMXNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR
UniProtP08485
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL317
IUPHAR16
DrugBankN/A

Ligand

NameVU0152117
Molecular formulaC22H28N4O3S
IUPAC name3-amino-6-[3-(dimethylamino)propoxy]-N-[(4-methoxyphenyl)methyl]-4-methylthieno[2,3-b]pyridine-2-carboxamide
Molecular weight428.551
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.2
Synonyms3-amino-6-[3-(dimethylamino)propoxy]-N-[(4-methoxyphenyl)methyl]-4-methyl-2-thieno[2,3-b]pyridinecarboxamide
3-amino-6-[3-(dimethylamino)propoxy]-N-[(4-methoxyphenyl)methyl]-4-methylthieno[2,3-b]pyridine-2-carboxamide
BDBM48057
3-amino-6-[3-(dimethylamino)propoxy]-4-methyl-N-p-anisyl-thieno[2,3-b]pyridine-2-carboxamide
3-azanyl-6-[3-(dimethylamino)propoxy]-N-[(4-methoxyphenyl)methyl]-4-methyl-thieno[2,3-b]pyridine-2-carboxamide
[ Show all ]
Inchi KeyJOVNETVRCHVSAD-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H28N4O3S/c1-14-12-17(29-11-5-10-26(2)3)25-22-18(14)19(23)20(30-22)21(27)24-13-15-6-8-16(28-4)9-7-15/h6-9,12H,5,10-11,13,23H2,1-4H3,(H,24,27)
PubChem CID45142469
ChEMBLN/A
IUPHARN/A
BindingDB48057
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC5010000.0 nMN/ABindingDB

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