BDBM50201284 3-((cyclohexylmethylamino)methyl)-N,N-dimethyl-3,4-dihydro-2H-benzo[b][1,4]dioxepin-3-amine::CHEMBL234257

SMILES: CN(C)C1(CNCC2CCCCC2)COc2ccccc2OC1

InChI Key: InChIKey=FWARLZJUQIRKFD-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50201284   

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))	BDBM50201284 (3-((cyclohexylmethylamino)methyl)-N,N-dimethyl-3,4...) Show SMILES CN(C)C1(CNCC2CCCCC2)COc2ccccc2OC1 Show InChI InChI=1S/C19H30N2O2/c1-21(2)19(13-20-12-16-8-4-3-5-9-16)14-22-17-10-6-7-11-18(17)23-15-19/h6-7,10-11,16,20H,3-5,8-9,12-15H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Mitsubishi Pharma Corporation Curated by ChEMBL					Assay Description Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M3 receptor expressed in Sf9 cells				Bioorg Med Chem Lett 17: 925-31 (2007) Article DOI: 10.1016/j.bmcl.2006.11.058 BindingDB Entry DOI: 10.7270/Q2DB81HZ
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M2 (Homo sapiens (Human))	BDBM50201284 (3-((cyclohexylmethylamino)methyl)-N,N-dimethyl-3,4...) Show SMILES CN(C)C1(CNCC2CCCCC2)COc2ccccc2OC1 Show InChI InChI=1S/C19H30N2O2/c1-21(2)19(13-20-12-16-8-4-3-5-9-16)14-22-17-10-6-7-11-18(17)23-15-19/h6-7,10-11,16,20H,3-5,8-9,12-15H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Mitsubishi Pharma Corporation Curated by ChEMBL					Assay Description Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M2 receptor expressed in Sf9 cells				Bioorg Med Chem Lett 17: 925-31 (2007) Article DOI: 10.1016/j.bmcl.2006.11.058 BindingDB Entry DOI: 10.7270/Q2DB81HZ
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human))	BDBM50201284 (3-((cyclohexylmethylamino)methyl)-N,N-dimethyl-3,4...) Show SMILES CN(C)C1(CNCC2CCCCC2)COc2ccccc2OC1 Show InChI InChI=1S/C19H30N2O2/c1-21(2)19(13-20-12-16-8-4-3-5-9-16)14-22-17-10-6-7-11-18(17)23-15-19/h6-7,10-11,16,20H,3-5,8-9,12-15H2,1-2H3	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Mitsubishi Pharma Corporation Curated by ChEMBL					Assay Description Displacement of 1-[N-methyl- 3H]scopolamine from human muscarinic M1 receptor expressed in Sf9 cells				Bioorg Med Chem Lett 17: 925-31 (2007) Article DOI: 10.1016/j.bmcl.2006.11.058 BindingDB Entry DOI: 10.7270/Q2DB81HZ
					More data for this Ligand-Target Pair