BDBM50023250 CHEMBL3329743

SMILES: CCN(Cc1cccc(F)c1)C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2cn[nH]c2c1

InChI Key: InChIKey=CKGYSTHIUNKLNT-UHFFFAOYSA-N

Data: 2 EC50

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 2 hits for monomerid = 50023250   

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 M5 (Homo sapiens (Human))	BDBM50023250 (CHEMBL3329743) Show SMILES CCN(Cc1cccc(F)c1)C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2cn[nH]c2c1 Show InChI InChI=1S/C22H25FN4O3S/c1-2-26(15-16-4-3-5-19(23)12-16)22(28)17-8-10-27(11-9-17)31(29,30)20-7-6-18-14-24-25-21(18)13-20/h3-7,12-14,17H,2,8-11,15H2,1H3,(H,24,25)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a
Vanderbilt University Medical Center Curated by ChEMBL					Assay Description Positive allosteric modulator activity at human muscarinic acetylcholine receptor subtype 5 expressed in CHO cells by calcium mobilization assay				J Med Chem 57: 7804-10 (2014) Article DOI: 10.1021/jm500995y BindingDB Entry DOI: 10.7270/Q2ST7RFM
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M5 (Homo sapiens (Human))	BDBM50023250 (CHEMBL3329743) Show SMILES CCN(Cc1cccc(F)c1)C(=O)C1CCN(CC1)S(=O)(=O)c1ccc2cn[nH]c2c1 Show InChI InChI=1S/C22H25FN4O3S/c1-2-26(15-16-4-3-5-19(23)12-16)22(28)17-8-10-27(11-9-17)31(29,30)20-7-6-18-14-24-25-21(18)13-20/h3-7,12-14,17H,2,8-11,15H2,1H3,(H,24,25)	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.51E+3	n/a	n/a	n/a	n/a
Vanderbilt University Medical Center Curated by ChEMBL					Assay Description Positive allosteric modulator activity at human muscarinic acetylcholine receptor subtype 5 expressed in CHO cells by calcium mobilization assay				J Med Chem 57: 7804-10 (2014) Article DOI: 10.1021/jm500995y BindingDB Entry DOI: 10.7270/Q2ST7RFM
					More data for this Ligand-Target Pair