BDBM50161175 CHEMBL3785845

SMILES: Cl.Brc1cccc(c1)C(=O)c1cc(C(=O)N[C@H]2CN3CCC2CC3)c2ccccn12

InChI Key: InChIKey=LLUMUETWSYICQC-FYZYNONXSA-N

Data: 1 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 1 hit for monomerid = 50161175   

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
Neuronal acetylcholine receptor protein alpha-7 subunit (Homo sapiens (Human))	BDBM50161175 (CHEMBL3785845) Show SMILES Cl.Brc1cccc(c1)C(=O)c1cc(C(=O)N[C@H]2CN3CCC2CC3)c2ccccn12 |r,wD:16.15,(9.33,-.63,;6.12,5.96,;5.74,4.79,;6.76,3.64,;6.28,2.18,;4.77,1.86,;3.75,3.01,;4.23,4.48,;2.24,2.7,;1.42,3.61,;1.76,1.24,;2.66,.02,;1.76,-1.24,;2.24,-2.7,;1.42,-3.62,;3.75,-3.01,;4.24,-4.47,;3.14,-5.65,;3.64,-7.18,;5.22,-7.52,;6.32,-6.32,;5.83,-4.77,;4.63,-5.27,;5,-6.47,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-2.38,.77,;-1.03,1.55,;.3,.77,)| Show InChI InChI=1S/C23H22BrN3O2.ClH/c24-17-5-3-4-16(12-17)22(28)21-13-18(20-6-1-2-9-27(20)21)23(29)25-19-14-26-10-7-15(19)8-11-26;/h1-6,9,12-13,15,19H,7-8,10-11,14H2,(H,25,29);1H/t19-;/m0./s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Agonist activity at human alpha7 nAChR expressed in xenopus oocytes preincubated for 10 mins followed by acetylcholine addition by patch clamp electr...				Eur J Med Chem 115: 94-108 (2016) BindingDB Entry DOI: 10.7270/Q2W37Z6N
					More data for this Ligand-Target Pair