BDBM50129259 CHEMBL3629539

SMILES: COc1ccc(CCNC(=O)NCC2(CCN(C)CC2)c2ccccc2)cc1

InChI Key: InChIKey=LLZBHPGNKFIHAD-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 = 50129259   

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))	BDBM50129259 (CHEMBL3629539) Show SMILES COc1ccc(CCNC(=O)NCC2(CCN(C)CC2)c2ccccc2)cc1 Show InChI InChI=1S/C23H31N3O2/c1-26-16-13-23(14-17-26,20-6-4-3-5-7-20)18-25-22(27)24-15-12-19-8-10-21(28-2)11-9-19/h3-11H,12-18H2,1-2H3,(H2,24,25,27)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	3.55E+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 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))	BDBM50129259 (CHEMBL3629539) Show SMILES COc1ccc(CCNC(=O)NCC2(CCN(C)CC2)c2ccccc2)cc1 Show InChI InChI=1S/C23H31N3O2/c1-26-16-13-23(14-17-26,20-6-4-3-5-7-20)18-25-22(27)24-15-12-19-8-10-21(28-2)11-9-19/h3-11H,12-18H2,1-2H3,(H2,24,25,27)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	4.30E+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 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))	BDBM50129259 (CHEMBL3629539) Show SMILES COc1ccc(CCNC(=O)NCC2(CCN(C)CC2)c2ccccc2)cc1 Show InChI InChI=1S/C23H31N3O2/c1-26-16-13-23(14-17-26,20-6-4-3-5-7-20)18-25-22(27)24-15-12-19-8-10-21(28-2)11-9-19/h3-11H,12-18H2,1-2H3,(H2,24,25,27)	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	5.40E+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