Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetMuscarinic acetylcholine receptor M2
LigandBDBM50522824
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1888527 (CHEMBL4390204)
Ki 2.6±n/a nM
Citation Yamashita, YTanaka, KIYamakawa, NAsano, TKanda, YTakafuji, AKawahara, MTakenaga, MFukunishi, YMizushima, T Chemical modification-mediated optimisation of bronchodilatory activity of mepenzolate, a muscarinic receptor antagonist with anti-inflammatory activity. Bioorg Med Chem27:3339-3346 (2019) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Muscarinic acetylcholine receptor M2
Name:Muscarinic acetylcholine receptor M2
Synonyms:ACM2_HUMAN | CHRM2 | Cholinergic, muscarinic M2 | Muscarinic acetylcholine receptor M2 and M4 | Muscarinic acetylcholine receptor M2 and M5 | RecName: Full=Muscarinic acetylcholine receptor M2
Type:GPCR
Mol. Mass.:51730.61
Organism:Homo sapiens (Human)
Description:P08172
Residue:466
Sequence:
MNNSTNSSNNSLALTSPYKTFEVVFIVLVAGSLSLVTIIGNILVMVSIKVNRHLQTVNNY
FLFSLACADLIIGVFSMNLYTLYTVIGYWPLGPVVCDLWLALDYVVSNASVMNLLIISFD
RYFCVTKPLTYPVKRTTKMAGMMIAAAWVLSFILWAPAILFWQFIVGVRTVEDGECYIQF
FSNAAVTFGTAIAAFYLPVIIMTVLYWHISRASKSRIKKDKKEPVANQDPVSPSLVQGRI
VKPNNNNMPSSDDGLEHNKIQNGKAPRDPVTENCVQGEEKESSNDSTSVSAVASNMRDDE
ITQDENTVSTSLGHSKDENSKQTCIRIGTKTPKSDSCTPTNTTVEVVGSSGQNGDEKQNI
VARKIVKMTKQPAKKKPPPSREKKVTRTILAILLAFIITWAPYNVMVLINTFCAPCIPNT
VWTIGYWLCYINSTINPACYALCNATFKKTFKHLLMCHYKNIGATR
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50522824
n/a
NameBDBM50522824
Synonyms:CHEMBL4521993
TypeSmall organic molecule
Emp. Form.C31H33BrF3NO4
Mol. Mass.620.497
SMILES[Br-].OC(C(=O)OC1C[N+]2(CCCc3ccc(OC(F)(F)F)cc3)CCC1CC2)(c1ccccc1)c1ccccc1 |(60.52,-35.48,;50.59,-37.33,;51.93,-38.1,;53.27,-38.87,;53.27,-40.41,;54.6,-38.09,;55.93,-38.86,;57.26,-38.08,;58.59,-38.86,;59.92,-38.09,;61.25,-38.86,;62.59,-38.1,;63.92,-38.87,;63.91,-40.41,;65.24,-41.18,;66.58,-40.41,;67.91,-41.19,;67.91,-42.73,;69.25,-43.5,;66.58,-43.49,;67.9,-44.27,;66.58,-38.87,;65.25,-38.1,;58.59,-40.4,;57.26,-41.16,;55.93,-40.4,;57.43,-40.2,;57.08,-39.15,;51.92,-36.56,;53.26,-35.79,;53.25,-34.25,;51.92,-33.48,;50.58,-34.27,;50.59,-35.8,;50.6,-38.88,;49.26,-38.1,;47.93,-38.88,;47.94,-40.42,;49.28,-41.18,;50.61,-40.41,)|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: