Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 373.2 BDBM86293

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 5 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM86293 (3-[4-(2-Methyl-3-(4-bromobenzyl)-1H-imidazolium-1-...) Show SMILES Cc1n(CC#CCOc2ccon2)cc[n+]1-c1ccc(Br)cc1 Show InChI InChI=1S/C17H15BrN3O2/c1-14-20(9-2-3-12-22-17-8-13-23-19-17)10-11-21(14)16-6-4-15(18)5-7-16/h4-8,10-11,13H,9,12H2,1H3/q+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	17.0	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit&aagrove; di Milano Curated by PDSP Ki Database									Farmaco 58: 739-48 (2003) Article DOI: 10.1016/S0014-827X(03)00113-7 BindingDB Entry DOI: 10.7270/Q21G0JVK
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M5 (Homo sapiens (Human))	BDBM86293 (3-[4-(2-Methyl-3-(4-bromobenzyl)-1H-imidazolium-1-...) Show SMILES Cc1n(CC#CCOc2ccon2)cc[n+]1-c1ccc(Br)cc1 Show InChI InChI=1S/C17H15BrN3O2/c1-14-20(9-2-3-12-22-17-8-13-23-19-17)10-11-21(14)16-6-4-15(18)5-7-16/h4-8,10-11,13H,9,12H2,1H3/q+1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	60.3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit&aagrove; di Milano Curated by PDSP Ki Database									Farmaco 58: 739-48 (2003) Article DOI: 10.1016/S0014-827X(03)00113-7 BindingDB Entry DOI: 10.7270/Q21G0JVK
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM86293 (3-[4-(2-Methyl-3-(4-bromobenzyl)-1H-imidazolium-1-...) Show SMILES Cc1n(CC#CCOc2ccon2)cc[n+]1-c1ccc(Br)cc1 Show InChI InChI=1S/C17H15BrN3O2/c1-14-20(9-2-3-12-22-17-8-13-23-19-17)10-11-21(14)16-6-4-15(18)5-7-16/h4-8,10-11,13H,9,12H2,1H3/q+1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	112	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit&aagrove; di Milano Curated by PDSP Ki Database									Farmaco 58: 739-48 (2003) Article DOI: 10.1016/S0014-827X(03)00113-7 BindingDB Entry DOI: 10.7270/Q21G0JVK
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M4 (Homo sapiens (Human))	BDBM86293 (3-[4-(2-Methyl-3-(4-bromobenzyl)-1H-imidazolium-1-...) Show SMILES Cc1n(CC#CCOc2ccon2)cc[n+]1-c1ccc(Br)cc1 Show InChI InChI=1S/C17H15BrN3O2/c1-14-20(9-2-3-12-22-17-8-13-23-19-17)10-11-21(14)16-6-4-15(18)5-7-16/h4-8,10-11,13H,9,12H2,1H3/q+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	209	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit&aagrove; di Milano Curated by PDSP Ki Database									Farmaco 58: 739-48 (2003) Article DOI: 10.1016/S0014-827X(03)00113-7 BindingDB Entry DOI: 10.7270/Q21G0JVK
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human))	BDBM86293 (3-[4-(2-Methyl-3-(4-bromobenzyl)-1H-imidazolium-1-...) Show SMILES Cc1n(CC#CCOc2ccon2)cc[n+]1-c1ccc(Br)cc1 Show InChI InChI=1S/C17H15BrN3O2/c1-14-20(9-2-3-12-22-17-8-13-23-19-17)10-11-21(14)16-6-4-15(18)5-7-16/h4-8,10-11,13H,9,12H2,1H3/q+1	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	871	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit&aagrove; di Milano Curated by PDSP Ki Database									Farmaco 58: 739-48 (2003) Article DOI: 10.1016/S0014-827X(03)00113-7 BindingDB Entry DOI: 10.7270/Q21G0JVK
					More data for this Ligand-Target Pair