BDBM50044697 (3-Chloro-phenyl)-carbamic acid 4-(3-ethyl-2,4-dioxo-1-oxa-3,8-diaza-spiro[4.5]dec-8-yl)-but-2-ynyl ester::CHEMBL542879

SMILES: CCN1C(=O)OC2(CCN(CC#CCOC(=O)Nc3cccc(Cl)c3)CC2)C1=O

InChI Key: InChIKey=CQONLJVSCIJCSP-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50044697   

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 M1 (RAT)	BDBM50044697 ((3-Chloro-phenyl)-carbamic acid 4-(3-ethyl-2,4-dio...) Show SMILES CCN1C(=O)OC2(CCN(CC#CCOC(=O)Nc3cccc(Cl)c3)CC2)C1=O Show InChI InChI=1S/C20H22ClN3O5/c1-2-24-17(25)20(29-19(24)27)8-11-23(12-9-20)10-3-4-13-28-18(26)22-16-7-5-6-15(21)14-16/h5-7,14H,2,8-13H2,1H3,(H,22,26)	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Drug Discovery Research Curated by ChEMBL					Assay Description Displacement of [3H]pirenzepine from rat cortex membrane expressing muscarinic M1 receptor				J Med Chem 36: 2292-9 (1993) BindingDB Entry DOI: 10.7270/Q2W66MDV
					More data for this Ligand-Target Pair