BDBM50318703 CHEMBL1083972::Methyl 5-Amino-2-methyl-7,8-dihydro-6H-cyclopenta-[b][1,8]naphthyridine-3-carboxylate

SMILES: COC(=O)c1cc2c(N)c3CCCc3nc2nc1C

InChI Key: InChIKey=MQPBTVIMKAUQQC-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50318703   

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
Butyrylcholinesterase (BuChE) (Equus caballus (Horse))	BDBM50318703 (CHEMBL1083972 | Methyl 5-Amino-2-methyl-7,8-dihydr...) Show SMILES COC(=O)c1cc2c(N)c3CCCc3nc2nc1C Show InChI InChI=1S/C14H15N3O2/c1-7-9(14(18)19-2)6-10-12(15)8-4-3-5-11(8)17-13(10)16-7/h6H,3-5H2,1-2H3,(H2,15,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Autonoma de Madrid Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE by Ellman's method				J Med Chem 53: 5129-43 (2010) Article DOI: 10.1021/jm901902w BindingDB Entry DOI: 10.7270/Q25T3MFV
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50318703 (CHEMBL1083972 | Methyl 5-Amino-2-methyl-7,8-dihydr...) Show SMILES COC(=O)c1cc2c(N)c3CCCc3nc2nc1C Show InChI InChI=1S/C14H15N3O2/c1-7-9(14(18)19-2)6-10-12(15)8-4-3-5-11(8)17-13(10)16-7/h6H,3-5H2,1-2H3,(H2,15,16,17)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Autonoma de Madrid Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by Ellman's method				J Med Chem 53: 5129-43 (2010) Article DOI: 10.1021/jm901902w BindingDB Entry DOI: 10.7270/Q25T3MFV
					More data for this Ligand-Target Pair
Acetylcholinesterase (Bos taurus (bovine))	BDBM50318703 (CHEMBL1083972 | Methyl 5-Amino-2-methyl-7,8-dihydr...) Show SMILES COC(=O)c1cc2c(N)c3CCCc3nc2nc1C Show InChI InChI=1S/C14H15N3O2/c1-7-9(14(18)19-2)6-10-12(15)8-4-3-5-11(8)17-13(10)16-7/h6H,3-5H2,1-2H3,(H2,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Autonoma de Madrid Curated by ChEMBL					Assay Description Displacement of propidium iodide from AChE in bovine erythrocytes after 15 mins by fluorescence plate reader				J Med Chem 53: 5129-43 (2010) Article DOI: 10.1021/jm901902w BindingDB Entry DOI: 10.7270/Q25T3MFV
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50318703 (CHEMBL1083972 | Methyl 5-Amino-2-methyl-7,8-dihydr...) Show SMILES COC(=O)c1cc2c(N)c3CCCc3nc2nc1C Show InChI InChI=1S/C14H15N3O2/c1-7-9(14(18)19-2)6-10-12(15)8-4-3-5-11(8)17-13(10)16-7/h6H,3-5H2,1-2H3,(H2,15,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad Autonoma de Madrid Curated by ChEMBL					Assay Description Inhibition of AChE in human erythrocytes by Ellman's method				J Med Chem 53: 5129-43 (2010) Article DOI: 10.1021/jm901902w BindingDB Entry DOI: 10.7270/Q25T3MFV
					More data for this Ligand-Target Pair