null

SMILES: C[N+]1(CC(=O)c2cccc(F)c2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1

InChI Key: InChIKey=XONNUPKRLWJHEZ-HSGLFRJESA-O

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50208029   

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))	BDBM50208029 (1-methyl-3-(R)-3-[4,4-bis-(4-fluoro-phenyl)-2-oxo-...) Show SMILES C[N+]1(CC(=O)c2cccc(F)c2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H26F3N3O2/c1-34(17-26(35)19-3-2-4-24(31)15-19)14-13-25(16-34)33-18-28(32-27(33)36,20-5-9-22(29)10-6-20)21-7-11-23(30)12-8-21/h2-12,15,25H,13-14,16-18H2,1H3/p+1/t25-,34?/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	3.01	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M3 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50208029 (1-methyl-3-(R)-3-[4,4-bis-(4-fluoro-phenyl)-2-oxo-...) Show SMILES C[N+]1(CC(=O)c2cccc(F)c2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H26F3N3O2/c1-34(17-26(35)19-3-2-4-24(31)15-19)14-13-25(16-34)33-18-28(32-27(33)36,20-5-9-22(29)10-6-20)21-7-11-23(30)12-8-21/h2-12,15,25H,13-14,16-18H2,1H3/p+1/t25-,34?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	108	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Displacement of [3H]N-methyl-scopalamine from human muscarinic M2 receptor expressed in CHOK1 cells				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50208029 (1-methyl-3-(R)-3-[4,4-bis-(4-fluoro-phenyl)-2-oxo-...) Show SMILES C[N+]1(CC(=O)c2cccc(F)c2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H26F3N3O2/c1-34(17-26(35)19-3-2-4-24(31)15-19)14-13-25(16-34)33-18-28(32-27(33)36,20-5-9-22(29)10-6-20)21-7-11-23(30)12-8-21/h2-12,15,25H,13-14,16-18H2,1H3/p+1/t25-,34?/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.80	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Activity at muscarinic M3 receptor in Albino Dunkin-Hartley guinea pig trachea assessed as inhibition of carbachol-induced contraction				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50208029 (1-methyl-3-(R)-3-[4,4-bis-(4-fluoro-phenyl)-2-oxo-...) Show SMILES C[N+]1(CC(=O)c2cccc(F)c2)CC[C@H](C1)N1CC(NC1=O)(c1ccc(F)cc1)c1ccc(F)cc1 Show InChI InChI=1S/C28H26F3N3O2/c1-34(17-26(35)19-3-2-4-24(31)15-19)14-13-25(16-34)33-18-28(32-27(33)36,20-5-9-22(29)10-6-20)21-7-11-23(30)12-8-21/h2-12,15,25H,13-14,16-18H2,1H3/p+1/t25-,34?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Via Zambeletti 25 Curated by ChEMBL					Assay Description Activity at muscarinic M2 receptor in Albino Dunkin-Hartley guinea pig left atria assessed as inhibition of methacholine-induced bradycardia				J Med Chem 50: 1693-7 (2007) Article DOI: 10.1021/jm061160+ BindingDB Entry DOI: 10.7270/Q2M32VF5
					More data for this Ligand-Target Pair