BDBM50275305 3-((2,2-Dimethylazetidine-1-carbonyloxy)-1-methylpropyl)dimethylammonium Oxalate::CHEMBL528765

SMILES: CC(CCOC(=O)N1CCC1(C)C)N(C)C

InChI Key: InChIKey=QLPIWKCAQGXORE-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50275305   

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
Neuronal acetylcholine receptor subunit alpha-3 (Rattus norvegicus (Rat))	BDBM50275305 (3-((2,2-Dimethylazetidine-1-carbonyloxy)-1-methylp...) Show SMILES CC(CCOC(=O)N1CCC1(C)C)N(C)C Show InChI InChI=1S/C12H24N2O2/c1-10(13(4)5)6-9-16-11(15)14-8-7-12(14,2)3/h10H,6-9H2,1-5H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	51	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Agonist activity at rat alpha-3-beta-4 nAChR expressed in HEK293 cells by FMP assay				J Med Chem 51: 7380-95 (2009) Article DOI: 10.1021/jm701625v BindingDB Entry DOI: 10.7270/Q2DF6S4D
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor (Rattus norvegicus (Rat))	BDBM50275305 (3-((2,2-Dimethylazetidine-1-carbonyloxy)-1-methylp...) Show SMILES CC(CCOC(=O)N1CCC1(C)C)N(C)C Show InChI InChI=1S/C12H24N2O2/c1-10(13(4)5)6-9-16-11(15)14-8-7-12(14,2)3/h10H,6-9H2,1-5H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]epibatidine from rat recombinant alpha4beta2 nAChR expressed in HEK293 cells				J Med Chem 51: 7380-95 (2009) Article DOI: 10.1021/jm701625v BindingDB Entry DOI: 10.7270/Q2DF6S4D
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor (Rattus norvegicus (Rat))	BDBM50275305 (3-((2,2-Dimethylazetidine-1-carbonyloxy)-1-methylp...) Show SMILES CC(CCOC(=O)N1CCC1(C)C)N(C)C Show InChI InChI=1S/C12H24N2O2/c1-10(13(4)5)6-9-16-11(15)14-8-7-12(14,2)3/h10H,6-9H2,1-5H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]epibatidine from rat recombinant alpha-4-beta-4 nAChR expressed in HEK293 cells				J Med Chem 51: 7380-95 (2009) Article DOI: 10.1021/jm701625v BindingDB Entry DOI: 10.7270/Q2DF6S4D
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-3 (Rattus norvegicus (Rat))	BDBM50275305 (3-((2,2-Dimethylazetidine-1-carbonyloxy)-1-methylp...) Show SMILES CC(CCOC(=O)N1CCC1(C)C)N(C)C Show InChI InChI=1S/C12H24N2O2/c1-10(13(4)5)6-9-16-11(15)14-8-7-12(14,2)3/h10H,6-9H2,1-5H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]epibatidine from rat recombinant alpha-3-beta-4 nAChR expressed in HEK293 cells				J Med Chem 51: 7380-95 (2009) Article DOI: 10.1021/jm701625v BindingDB Entry DOI: 10.7270/Q2DF6S4D
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor (Rattus norvegicus (Rat))	BDBM50275305 (3-((2,2-Dimethylazetidine-1-carbonyloxy)-1-methylp...) Show SMILES CC(CCOC(=O)N1CCC1(C)C)N(C)C Show InChI InChI=1S/C12H24N2O2/c1-10(13(4)5)6-9-16-11(15)14-8-7-12(14,2)3/h10H,6-9H2,1-5H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Displacement of [3H]MLA from rat alpha-7 nAChR/mouse 5HT3A chimera expressed in human tsA-201 cells				J Med Chem 51: 7380-95 (2009) Article DOI: 10.1021/jm701625v BindingDB Entry DOI: 10.7270/Q2DF6S4D
					More data for this Ligand-Target Pair