Reaction Details Report a problem with these data
Target
Muscarinic acetylcholine receptor M3
Ligand
BDBM228846
Substrate
n/a
Meas. Tech.
[3H]-NMS Binding Assay
IC50
31±n/a nM
Citation
 Fernandez Forner, MD; Prat Quinones, M; Buil Albero, MA Quinuclidine derivatives and medicinal compositions containing the same US Patent  US9333195 Publication Date 5/10/2016 
Target
Name:
Muscarinic acetylcholine receptor M3
Synonyms:
ACM3_HUMAN | CHRM3 | Cholinergic, muscarinic M3 | Muscarinic Receptors M3 | Muscarinic receptor M3 | RecName: Full=Muscarinic acetylcholine receptor M3
Type:
Enzyme
Mol. Mass.:
66151.03
Organism:
Homo sapiens (Human)
Description:
P20309
Residue:
590
Sequence:
MTLHNNSTTSPLFPNISSSWIHSPSDAGLPPGTVTHFGSYNVSRAAGNFSSPDGTTDDPLGGHTVWQVVFIAFLTGILALVTIIGNILVIVSFKVNKQLKTVNNYFLLSLACADLIIGVISMNLFTTYIIMNRWALGNLACDLWLAIDYVASNASVMNLLVISFDRYFSITRPLTYRAKRTTKRAGVMIGLAWVISFVLWAPAILFWQYFVGKRTVPPGECFIQFLSEPTITFGTAIAAFYMPVTIMTILYWRIYKETEKRTKELAGLQASGTEAETENFVHPTGSSRSCSSYELQQQSMKRSNRRKYGRCHFWFTTKSWKPSSEQMDQDHSSSDSWNNNDAAASLENSASSDEEDIGSETRAIYSIVLKLPGHSTILNSTKLPSSDNLQVPEEELGMVDLERKADKLQAQKSVDDGGSFPKSFSKLPIQLESAVDTAKTSDVNSSVGKSTATLPLSFKEATLAKRFALKTRSQITKRKRMSLVKEKKAAQTLSAILLAFIITWTPYNIMVLVNTFCDSCIPKTFWNLGYWLCYINSTVNPVCYALCNKTFRTTFKMLLLCQCDKKKRRKQQYQQRQSVIFHKRAPEQAL
  
Inhibitor
Name:
BDBM228846
Synonyms:
US9333195, 1
Type:
Small Organic Molecule
Emp. Form.:
C30H34NO3
Mol. Mass.:
456.5953
SMILES:
O=C(O[C@@H]1CC2CC[N+]1(CCCOc1ccccc1)CC2)C(c1ccccc1)c1ccccc1 |wU:3.2,THB:2:3:7.6:20.19,(6.43,-3.49,;5.86,-4.92,;4.34,-5.14,;3.39,-3.93,;3.1,-2.51,;1.72,-1.89,;1.79,-.21,;2.25,-1.34,;1.99,-3.28,;1.97,-4.82,;3.29,-5.61,;3.26,-7.15,;1.92,-7.9,;.6,-7.11,;-.75,-7.86,;-2.07,-7.07,;-2.05,-5.53,;-.7,-4.78,;.62,-5.57,;.42,-3.95,;.22,-2.54,;6.82,-6.13,;8.34,-5.91,;8.91,-4.48,;10.44,-4.26,;11.39,-5.47,;10.82,-6.9,;9.29,-7.12,;6.24,-7.56,;7.2,-8.77,;6.63,-10.2,;5.1,-10.42,;4.15,-9.21,;4.72,-7.78,)|
Structure:
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