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SMILES: C[N+]1(C)[C@@H]2CC[C@@H]1CC(CC(O)(c1cc(F)cc(F)c1)c1cc(F)cc(F)c1)C2

InChI Key: InChIKey=LWIJJMUZDJEHEX-FGZHOGPDSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50345687   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))		BDBM50345687
PNG
((3-endo)-3-[2,2-Bis(3,5-difluorophenyl)-2-hydroxye...)
Show SMILES C[N+]1(C)[C@@H]2CC[C@@H]1CC(CC(O)(c1cc(F)cc(F)c1)c1cc(F)cc(F)c1)C2 |r,THB:9:8:1:4.5|
Show InChI InChI=1S/C23H26F4NO/c1-28(2)21-3-4-22(28)6-14(5-21)13-23(29,15-7-17(24)11-18(25)8-15)16-9-19(26)12-20(27)10-16/h7-12,14,21-22,29H,3-6,13H2,1-2H3/q+1/t21-,22-/m1/s1
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Similars
Article
PubMed
n/an/a 112n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Antagonist activity against human M3 receptor expressed in CHO cells assessed as inhibition of acetylcholine-induced calcium mobilization by FLIPR

J Med Chem 52: 5241-52 (2010)


Article DOI: 10.1021/jm900736e
BindingDB Entry DOI: 10.7270/Q2PK0H54
More data for this
Ligand-Target Pair