BDBM50176730 (R)-3-(8-methoxyquinuclidin-8-yl)-1,1-di(pyridin-3-yl)prop-2-yn-1-ol::CHEMBL381469

SMILES: CO[C@@]1(CN2CCC1CC2)C#CC(O)(c1cccnc1)c1cccnc1

InChI Key: InChIKey=KXTCGQZDSVQUGY-HXUWFJFHSA-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 = 50176730   

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))	BDBM50176730 ((R)-3-(8-methoxyquinuclidin-8-yl)-1,1-di(pyridin-3...) Show SMILES CO[C@@]1(CN2CCC1CC2)C#CC(O)(c1cccnc1)c1cccnc1 |wU:2.1,wD:2.11,THB:1:2:5.6:9.8,(24.67,-12.3,;26.2,-12.27,;27.01,-13.59,;27.57,-14.86,;28.86,-13.81,;30.34,-14.04,;29.7,-12.78,;28.24,-12.57,;27.86,-10.98,;28.59,-11.92,;25.67,-14.37,;24.35,-15.16,;23.03,-15.95,;22.24,-14.63,;21.7,-16.73,;21.72,-18.27,;20.41,-19.06,;19.06,-18.31,;19.04,-16.77,;20.36,-15.98,;23.81,-17.27,;23.07,-18.61,;23.85,-19.94,;25.38,-19.91,;26.13,-18.57,;25.35,-17.26,)| Show InChI InChI=1S/C21H23N3O2/c1-26-20(16-24-12-6-17(20)7-13-24)8-9-21(25,18-4-2-10-22-14-18)19-5-3-11-23-15-19/h2-5,10-11,14-15,17,25H,6-7,12-13,16H2,1H3/t20-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50	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))	BDBM50176730 ((R)-3-(8-methoxyquinuclidin-8-yl)-1,1-di(pyridin-3...) Show SMILES CO[C@@]1(CN2CCC1CC2)C#CC(O)(c1cccnc1)c1cccnc1 |wU:2.1,wD:2.11,THB:1:2:5.6:9.8,(24.67,-12.3,;26.2,-12.27,;27.01,-13.59,;27.57,-14.86,;28.86,-13.81,;30.34,-14.04,;29.7,-12.78,;28.24,-12.57,;27.86,-10.98,;28.59,-11.92,;25.67,-14.37,;24.35,-15.16,;23.03,-15.95,;22.24,-14.63,;21.7,-16.73,;21.72,-18.27,;20.41,-19.06,;19.06,-18.31,;19.04,-16.77,;20.36,-15.98,;23.81,-17.27,;23.07,-18.61,;23.85,-19.94,;25.38,-19.91,;26.13,-18.57,;25.35,-17.26,)| Show InChI InChI=1S/C21H23N3O2/c1-26-20(16-24-12-6-17(20)7-13-24)8-9-21(25,18-4-2-10-22-14-18)19-5-3-11-23-15-19/h2-5,10-11,14-15,17,25H,6-7,12-13,16H2,1H3/t20-/m1/s1	PDB UniProtKB/SwissProt 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 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