Ki Summary

Reaction Details

Report a problem with these data

Target

Muscarinic acetylcholine receptor M3

Ligand

BDBM200745

Substrate/Competitor

n/a

Meas. Tech.

Muscarinic Receptor Binding Assay

IC50

1.4±n/a nM

Citation

Aiguade Bosch, J; Gual Roig, S; Prat Quinones, M; Puig Duran, C Cyclohexylamine derivatives having β2 adrenergic agonist and M3 muscarinic antagonist activities US Patent US9233108 Publication Date 1/12/2016

More Info.:

Get all data from this article, Assay Method

Muscarinic acetylcholine receptor M3

Name:

Muscarinic acetylcholine receptor M3

Synonyms:

Type:

Enzyme

Mol. Mass.:

66151.03

Organism:

Homo sapiens (Human)

Description:

P20309

Residue:

590

Sequence:

MTLHNNSTTSPLFPNISSSWIHSPSDAGLPPGTVTHFGSYNVSRAAGNFSSPDGTTDDPL
GGHTVWQVVFIAFLTGILALVTIIGNILVIVSFKVNKQLKTVNNYFLLSLACADLIIGVI
SMNLFTTYIIMNRWALGNLACDLWLAIDYVASNASVMNLLVISFDRYFSITRPLTYRAKR
TTKRAGVMIGLAWVISFVLWAPAILFWQYFVGKRTVPPGECFIQFLSEPTITFGTAIAAF
YMPVTIMTILYWRIYKETEKRTKELAGLQASGTEAETENFVHPTGSSRSCSSYELQQQSM
KRSNRRKYGRCHFWFTTKSWKPSSEQMDQDHSSSDSWNNNDAAASLENSASSDEEDIGSE
TRAIYSIVLKLPGHSTILNSTKLPSSDNLQVPEEELGMVDLERKADKLQAQKSVDDGGSF
PKSFSKLPIQLESAVDTAKTSDVNSSVGKSTATLPLSFKEATLAKRFALKTRSQITKRKR
MSLVKEKKAAQTLSAILLAFIITWTPYNIMVLVNTFCDSCIPKTFWNLGYWLCYINSTVN
PVCYALCNKTFRTTFKMLLLCQCDKKKRRKQQYQQRQSVIFHKRAPEQAL

BDBM200745

n/a

Name

BDBM200745

Synonyms:

US9233108, 6

Type

Small organic molecule

Emp. Form.

C40H45N4O8S2

Mol. Mass.

773.938

SMILES

CN(CCN(C)C(=O)COc1ccc(CNC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)cc1)[C@H]1CC[C@@H](CC1)OC(C([O-])=O)(c1cccs1)c1cccs1 |wU:36.42,wD:17.17,33.35,(.89,-8.55,;.39,-10.01,;-1.12,-10.3,;-2.13,-9.14,;-3.64,-9.43,;-4.15,-10.88,;-4.65,-8.26,;-4.15,-6.81,;-6.16,-8.55,;-6.67,-10.01,;-8.18,-10.3,;-9.19,-9.14,;-10.7,-9.43,;-11.21,-10.88,;-12.72,-11.17,;-13.22,-12.63,;-14.73,-12.92,;-15.24,-14.38,;-14.23,-15.54,;-16.75,-14.67,;-17.76,-13.5,;-19.27,-13.79,;-19.77,-15.25,;-21.29,-15.54,;-18.77,-16.41,;-19.27,-17.87,;-18.26,-19.03,;-18.77,-20.49,;-16.75,-18.74,;-16.25,-17.29,;-17.25,-16.12,;-10.2,-12.05,;-8.68,-11.76,;1.4,-11.17,;.89,-12.63,;1.9,-13.79,;3.41,-13.5,;3.92,-12.05,;2.91,-10.88,;4.42,-14.67,;5.93,-14.38,;5.64,-12.86,;4.76,-11.6,;6.81,-11.86,;6.22,-15.89,;7.62,-16.54,;7.43,-18.07,;5.92,-18.36,;5.17,-17.01,;7.45,-14.08,;8.1,-12.69,;9.63,-12.88,;9.92,-14.39,;8.57,-15.14,)|

Structure