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Name | Muscarinic acetylcholine receptor M1 |
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Species | Homo sapiens (Human) |
Gene | CHRM1 |
Synonym | cholinergic receptor cholinergic receptor, muscarinic 1 cholinergic receptor, muscarinic 1, CNS Chrm-1 M1 receptor [ Show all ] |
Disease | Functional bowel syndrome; Irritable bowel syndrome Glaucoma Peptic ulcer Parkinsonism; Extrapyramidal disorders secondary to neuroleptic drug therapy Visceral spasms [ Show all ] |
Length | 460 |
Amino acid sequence | MNTSAPPAVSPNITVLAPGKGPWQVAFIGITTGLLSLATVTGNLLVLISFKVNTELKTVNNYFLLSLACADLIIGTFSMNLYTTYLLMGHWALGTLACDLWLALDYVASNASVMNLLLISFDRYFSVTRPLSYRAKRTPRRAALMIGLAWLVSFVLWAPAILFWQYLVGERTVLAGQCYIQFLSQPIITFGTAMAAFYLPVTVMCTLYWRIYRETENRARELAALQGSETPGKGGGSSSSSERSQPGAEGSPETPPGRCCRCCRAPRLLQAYSWKEEEEEDEGSMESLTSSEGEEPGSEVVIKMPMVDPEAQAPTKQPPRSSPNTVKRPTKKGRDRAGKGQKPRGKEQLAKRKTFSLVKEKKAARTLSAILLAFILTWTPYNIMVLVSTFCKDCVPETLWELGYWLCYVNSTINPMCYALCNKAFRDTFRLLLLCRWDKRRWRKIPKRPGSVHRTPSRQC |
UniProt | P11229 |
Protein Data Bank | 5cxv |
GPCR-HGmod model | P11229 |
3D structure model | This structure is from PDB ID 5cxv. |
BioLiP | BL0339262, BL0339261, BL0339263 |
Therapeutic Target Database | T28893 |
ChEMBL | CHEMBL216 |
IUPHAR | 13 |
DrugBank | BE0000092 |
Name | McN-A-343 |
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Molecular formula | C14H18Cl2N2O2 |
IUPAC name | 4-[(3-chlorophenyl)carbamoyloxy]but-2-ynyl-trimethylazanium;chloride |
Molecular weight | 317.21 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | None |
Synonyms | 2-Butyn-1-aminium, 4-((((3-chlorophenyl)amino)carbonyl)oxy)-N,N,N-trimethyl-, chloride 55-45-8 Butyl-1-aminium, 4-((((3-chlorophenyl)amino)carbonyl)oxy)-N,N,N-trimethyl-, chloride DTXSID80203532 MCN A-343 [ Show all ] |
Inchi Key | CXFZFEJJLNLOTA-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H17ClN2O2.ClH/c1-17(2,3)9-4-5-10-19-14(18)16-13-8-6-7-12(15)11-13;/h6-8,11H,9-10H2,1-3H3;1H |
PubChem CID | 5926 |
ChEMBL | CHEMBL74300 |
IUPHAR | 290 |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | Partition coefficient log P of this ligand is not available. |
Parameter | Value | Reference | Database source |
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CCh | 57.0 % | Bioorg. Med. Chem. Lett., (1992) 2:8:821 | ChEMBL |
EC50 | 3500.0 nM | Bioorg. Med. Chem. Lett., (1992) 2:8:821 | ChEMBL |
IC50 | 4000.0 nM | Bioorg. Med. Chem. Lett., (1992) 2:8:821 | ChEMBL |
IC50 | 7240.0 nM | Bioorg. Med. Chem. Lett., (1992) 2:8:803 | ChEMBL |
Increase | 7.0 % | Bioorg. Med. Chem. Lett., (1992) 2:8:839 | ChEMBL |
Increase | 89.0 % | Bioorg. Med. Chem. Lett., (1992) 2:8:839 | ChEMBL |
Increase | 90.0 % | Bioorg. Med. Chem. Lett., (1992) 2:8:839 | ChEMBL |
Ki | 8.2 nM | PMID1704434 | PDSP |
Ki | 1949.84 nM | PMID19896386, PMID24980056 | ChEMBL |
Ki | 6309.57 - 15848.9 nM | PMID7620715 | IUPHAR |
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