BDBM50129179 CHEMBL3629530

SMILES: COc1ccc(CCOC(=O)C2(CCN(C)CC2)c2ccccc2)cc1

InChI Key: InChIKey=OPURXCGDAMNMQI-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 = 50129179   

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))	BDBM50129179 (CHEMBL3629530) Show SMILES COc1ccc(CCOC(=O)C2(CCN(C)CC2)c2ccccc2)cc1 Show InChI InChI=1S/C22H27NO3/c1-23-15-13-22(14-16-23,19-6-4-3-5-7-19)21(24)26-17-12-18-8-10-20(25-2)11-9-18/h3-11H,12-17H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	640	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human muscarinic M3 receptor expressed in CHO cells after 2 hrs by liquid scintillation spectrometry analysis				Bioorg Med Chem Lett 25: 5032-5 (2015) BindingDB Entry DOI: 10.7270/Q2S75J4G
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M5 (Homo sapiens (Human))	BDBM50129179 (CHEMBL3629530) Show SMILES COc1ccc(CCOC(=O)C2(CCN(C)CC2)c2ccccc2)cc1 Show InChI InChI=1S/C22H27NO3/c1-23-15-13-22(14-16-23,19-6-4-3-5-7-19)21(24)26-17-12-18-8-10-20(25-2)11-9-18/h3-11H,12-17H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	870	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human muscarinic M5 receptor expressed in CHO cells after 2 hrs by liquid scintillation spectrometry analysis				Bioorg Med Chem Lett 25: 5032-5 (2015) BindingDB Entry DOI: 10.7270/Q2S75J4G
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M1 (Homo sapiens (Human))	BDBM50129179 (CHEMBL3629530) Show SMILES COc1ccc(CCOC(=O)C2(CCN(C)CC2)c2ccccc2)cc1 Show InChI InChI=1S/C22H27NO3/c1-23-15-13-22(14-16-23,19-6-4-3-5-7-19)21(24)26-17-12-18-8-10-20(25-2)11-9-18/h3-11H,12-17H2,1-2H3	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Kentucky Curated by ChEMBL					Assay Description Displacement of [3H]NMS from human muscarinic M1 receptor expressed in CHO cells after 2 hrs by liquid scintillation spectrometry analysis				Bioorg Med Chem Lett 25: 5032-5 (2015) BindingDB Entry DOI: 10.7270/Q2S75J4G
					More data for this Ligand-Target Pair