BDBM50176713 (R)-3-(3-methoxyquinuclidin-3-yl)-1,1-dip-tolylprop-2-yn-1-ol::CHEMBL200209

SMILES: CO[C@@]1(CN2CCC1CC2)C#CC(O)(c1ccc(C)cc1)c1ccc(C)cc1

InChI Key: InChIKey=MMMQUSWLVGQDBX-XMMPIXPASA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50176713   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50176713 ((R)-3-(3-methoxyquinuclidin-3-yl)-1,1-dip-tolylpro...) Show SMILES CO[C@@]1(CN2CCC1CC2)C#CC(O)(c1ccc(C)cc1)c1ccc(C)cc1 |wU:2.1,wD:2.11,THB:1:2:5.6:9.8,(11.48,-25.76,;12.97,-26.15,;13.39,-27.64,;13.58,-29.02,;15.11,-28.37,;16.48,-29,;16.2,-27.6,;14.85,-27,;14.92,-25.36,;15.37,-26.47,;11.89,-28.04,;10.39,-28.44,;8.9,-28.83,;8.51,-27.35,;7.41,-29.23,;6.32,-28.14,;4.83,-28.53,;4.43,-30.02,;2.94,-30.42,;5.52,-31.12,;7.01,-30.72,;9.3,-30.32,;8.21,-31.41,;8.6,-32.89,;10.09,-33.3,;10.49,-34.78,;11.18,-32.2,;10.78,-30.72,)| Show InChI InChI=1S/C25H29NO2/c1-19-4-8-22(9-5-19)25(27,23-10-6-20(2)7-11-23)15-14-24(28-3)18-26-16-12-21(24)13-17-26/h4-11,21,27H,12-13,16-18H2,1-3H3/t24-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UCB Pharma Curated by ChEMBL					Assay Description Binding affinity to human muscarinic M3 receptor				Bioorg Med Chem Lett 16: 373-7 (2005) Article DOI: 10.1016/j.bmcl.2005.09.079 BindingDB Entry DOI: 10.7270/Q2T72J70
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50176713 ((R)-3-(3-methoxyquinuclidin-3-yl)-1,1-dip-tolylpro...) Show SMILES CO[C@@]1(CN2CCC1CC2)C#CC(O)(c1ccc(C)cc1)c1ccc(C)cc1 |wU:2.1,wD:2.11,THB:1:2:5.6:9.8,(11.48,-25.76,;12.97,-26.15,;13.39,-27.64,;13.58,-29.02,;15.11,-28.37,;16.48,-29,;16.2,-27.6,;14.85,-27,;14.92,-25.36,;15.37,-26.47,;11.89,-28.04,;10.39,-28.44,;8.9,-28.83,;8.51,-27.35,;7.41,-29.23,;6.32,-28.14,;4.83,-28.53,;4.43,-30.02,;2.94,-30.42,;5.52,-31.12,;7.01,-30.72,;9.3,-30.32,;8.21,-31.41,;8.6,-32.89,;10.09,-33.3,;10.49,-34.78,;11.18,-32.2,;10.78,-30.72,)| Show InChI InChI=1S/C25H29NO2/c1-19-4-8-22(9-5-19)25(27,23-10-6-20(2)7-11-23)15-14-24(28-3)18-26-16-12-21(24)13-17-26/h4-11,21,27H,12-13,16-18H2,1-3H3/t24-/m1/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	501	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
UCB Pharma Curated by ChEMBL					Assay Description Binding affinity to human muscarinic M2 receptor				Bioorg Med Chem Lett 16: 373-7 (2005) Article DOI: 10.1016/j.bmcl.2005.09.079 BindingDB Entry DOI: 10.7270/Q2T72J70
					More data for this Ligand-Target Pair