BDBM50289105 6,7,8,9,10,12-Hexahydro-azepino[2,1-b]quinazoline::CHEMBL165304

SMILES: C1N2CCCCCC2=Nc2ccccc12

InChI Key: InChIKey=SQXQVLHHMMAJIL-UHFFFAOYSA-N

Data: 2 IC50

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 = 50289105   

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
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50289105 (6,7,8,9,10,12-Hexahydro-azepino[2,1-b]quinazoline ...) Show SMILES C1N2CCCCCC2=Nc2ccccc12 |c:8| Show InChI InChI=1S/C13H16N2/c1-2-8-13-14-12-7-4-3-6-11(12)10-15(13)9-5-1/h3-4,6-7H,1-2,5,8-10H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against acetylcholinesterase in rat brain				Bioorg Med Chem Lett 6: 737-742 (1996) Article DOI: 10.1016/0960-894X(96)00102-3 BindingDB Entry DOI: 10.7270/Q2736RDK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50289105 (6,7,8,9,10,12-Hexahydro-azepino[2,1-b]quinazoline ...) Show SMILES C1N2CCCCCC2=Nc2ccccc12 |c:8| Show InChI InChI=1S/C13H16N2/c1-2-8-13-14-12-7-4-3-6-11(12)10-15(13)9-5-1/h3-4,6-7H,1-2,5,8-10H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	3.76E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory activity against acetylcholinesterase in human RBC				Bioorg Med Chem Lett 6: 737-742 (1996) Article DOI: 10.1016/0960-894X(96)00102-3 BindingDB Entry DOI: 10.7270/Q2736RDK
					More data for this Ligand-Target Pair