BDBM50220554 CHEMBL315127

SMILES: [O-][N+](=O)c1ccc(cc1)C(=O)N(C1CCN(Cc2ccccc2)CC1)c1ccccc1

InChI Key: InChIKey=BDFWFCFVBOIEON-UHFFFAOYSA-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 = 50220554   

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))	BDBM50220554 (CHEMBL315127) Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)N(C1CCN(Cc2ccccc2)CC1)c1ccccc1 Show InChI InChI=1S/C25H25N3O3/c29-25(21-11-13-24(14-12-21)28(30)31)27(22-9-5-2-6-10-22)23-15-17-26(18-16-23)19-20-7-3-1-4-8-20/h1-14,23H,15-19H2	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	794	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Libre de Bruxelles Curated by ChEMBL					Assay Description In vitro affinity for muscarinic M3 receptor.				Bioorg Med Chem Lett 12: 2535-9 (2002) BindingDB Entry DOI: 10.7270/Q2GT5PBW
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50220554 (CHEMBL315127) Show SMILES [O-][N+](=O)c1ccc(cc1)C(=O)N(C1CCN(Cc2ccccc2)CC1)c1ccccc1 Show InChI InChI=1S/C25H25N3O3/c29-25(21-11-13-24(14-12-21)28(30)31)27(22-9-5-2-6-10-22)23-15-17-26(18-16-23)19-20-7-3-1-4-8-20/h1-14,23H,15-19H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Libre de Bruxelles Curated by ChEMBL					Assay Description In vitro affinity for muscarinic M2 receptor.				Bioorg Med Chem Lett 12: 2535-9 (2002) BindingDB Entry DOI: 10.7270/Q2GT5PBW
					More data for this Ligand-Target Pair