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GPCR

NameMuscarinic acetylcholine receptor M4
SpeciesHomo sapiens (Human)
GeneCHRM4
SynonymHM3
M4 receptor
cholinergic receptor
Chrm-4
cholinergic receptor, muscarinic 4
DiseaseProduce mydriasis and cycloplegia for diagnostic purposes
Hypertension
Irritable bowel syndrome
Moderate and severe psychomotor agitation
Mydriasis diagnosis
[ Show all ]
Length479
Amino acid sequenceMANFTPVNGSSGNQSVRLVTSSSHNRYETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLACADLIIGAFSMNLYTVYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKQSVKKPPPGEAAREELRNGKLEEAPPPALPPPPRPVADKDTSNESSSGSATQNTKERPATELSTTEATTPAMPAPPLQPRALNPASRWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPDTVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR
UniProtP08173
Protein Data Bank5dsg
GPCR-HGmod modelP08173
3D structure modelThis structure is from PDB ID 5dsg.
BioLiPBL0339919,BL0339921, BL0339920
Therapeutic Target DatabaseT20709, T50918
ChEMBLCHEMBL1821
IUPHAR16
DrugBankBE0000405

Ligand

NameCHEMBL255692
Molecular formulaC36H46Cl2N2O2
IUPAC name4-[2-[(4-hydroxy-4,4-diphenylbutyl)-methylamino]ethyl-methylamino]-1,1-diphenylbutan-1-ol;dihydrochloride
Molecular weight609.676
Hydrogen bond acceptor4
Hydrogen bond donor4
XlogPNone
SynonymsN/A
Inchi KeyAGLGNGYZLGAMMU-UHFFFAOYSA-N
Inchi IDInChI=1S/C36H44N2O2.2ClH/c1-37(27-15-25-35(39,31-17-7-3-8-18-31)32-19-9-4-10-20-32)29-30-38(2)28-16-26-36(40,33-21-11-5-12-22-33)34-23-13-6-14-24-34;;/h3-14,17-24,39-40H,15-16,25-30H2,1-2H3;2*1H
PubChem CID49797390
ChEMBLCHEMBL255692
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Experimental Data

ParameterValueReferenceDatabase source
Ki162181.0 nMPMID18395442ChEMBL

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