BindingDB PrimarySearch

BDBM50111346 (2-Amino-3-methyl-phenyl)-{4-[4-(3-chloro-benzenesulfonyl)-benzyl]-[1,4']bipiperidinyl-1'-yl}-methanone::CHEMBL12098::SCH-211803

SMILES: Cc1cccc(C(=O)N2CCC(CC2)N2CCC(Cc3ccc(cc3)S(=O)(=O)c3cccc(Cl)c3)CC2)c1N

InChI Key: InChIKey=VMJKUCKTXMESQR-UHFFFAOYSA-N

Data: 8 KI

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50111346
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50111346 ((2-Amino-3-methyl-phenyl)-{4-[4-(3-chloro-benzenes...) Show SMILES Show InChI	PDB Reactome pathway UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Binding affinity against muscarinic acetylcholine receptor M2 stably expressed in CHO-K1 cells using [3H]-QNB as radioligand.				Bioorg Med Chem Lett 12: 1087-91 (2002) Article DOI: 10.1016/s0960-894x(02)00096-3 BindingDB Entry DOI: 10.7270/Q2MS3S2P
Schering-Plough Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50111346 ((2-Amino-3-methyl-phenyl)-{4-[4-(3-chloro-benzenes...) Show SMILES Show InChI	PDB Reactome pathway UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Binding affinity for human Muscarinic acetylcholine receptor M2				J Med Chem 45: 5415-8 (2002) Article DOI: 10.1021/jm0255163 BindingDB Entry DOI: 10.7270/Q2ST7P6N
Schering-Plough Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50111346 ((2-Amino-3-methyl-phenyl)-{4-[4-(3-chloro-benzenes...) Show SMILES Show InChI	PDB Reactome pathway UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Binding affinity against cloned human muscarinic acetylcholine receptor M2.				Bioorg Med Chem Lett 14: 1791-4 (2004) Article DOI: 10.1016/j.bmcl.2004.01.033 BindingDB Entry DOI: 10.7270/Q22N51QH
Schering-Plough Research Institute Curated by ChEMBL					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50111346 ((2-Amino-3-methyl-phenyl)-{4-[4-(3-chloro-benzenes...) Show SMILES Show InChI	PDB Reactome pathway UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	0.890	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Arkansas for Medical Sciences Curated by ChEMBL					Assay Description Binding affinity to human M2 muscarinic receptor				J Med Chem 56: 1693-703 (2013) Article DOI: 10.1021/jm301774u BindingDB Entry DOI: 10.7270/Q2765GN2
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M4 (Homo sapiens (Human))	BDBM50111346 ((2-Amino-3-methyl-phenyl)-{4-[4-(3-chloro-benzenes...) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	61	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Arkansas for Medical Sciences Curated by ChEMBL					Assay Description Binding affinity to human M4 muscarinic receptor				J Med Chem 56: 1693-703 (2013) Article DOI: 10.1021/jm301774u BindingDB Entry DOI: 10.7270/Q2765GN2
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M5 (Homo sapiens (Human))	BDBM50111346 ((2-Amino-3-methyl-phenyl)-{4-[4-(3-chloro-benzenes...) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	85	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Arkansas for Medical Sciences Curated by ChEMBL					Assay Description Binding affinity to human M5 muscarinic receptor				J Med Chem 56: 1693-703 (2013) Article DOI: 10.1021/jm301774u BindingDB Entry DOI: 10.7270/Q2765GN2
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human))	BDBM50111346 ((2-Amino-3-methyl-phenyl)-{4-[4-(3-chloro-benzenes...) Show SMILES Show InChI	Reactome pathway UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	653	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Arkansas for Medical Sciences Curated by ChEMBL					Assay Description Binding affinity to human M1 muscarinic receptor				J Med Chem 56: 1693-703 (2013) Article DOI: 10.1021/jm301774u BindingDB Entry DOI: 10.7270/Q2765GN2
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M3 (Homo sapiens (Human))	BDBM50111346 ((2-Amino-3-methyl-phenyl)-{4-[4-(3-chloro-benzenes...) Show SMILES Show InChI	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	700	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Arkansas for Medical Sciences Curated by ChEMBL					Assay Description Binding affinity to human M3 muscarinic receptor				J Med Chem 56: 1693-703 (2013) Article DOI: 10.1021/jm301774u BindingDB Entry DOI: 10.7270/Q2765GN2
					More data for this Ligand-Target Pair