Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 165.6 BDBM50058288

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Putative agmatine deiminase (Streptococcus mutans serotype c (strain ATCC 70061...)	BDBM50058288 (CHEMBL3361348) Show SMILES [NH3+]CCCCNC(=[NH2+])CCl Show InChI InChI=1S/C6H14ClN3/c7-5-6(9)10-4-2-1-3-8/h1-5,8H2,(H2,9,10)/p+2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
University of North Florida Curated by ChEMBL					Assay Description Inhibition of Streptococcus mutans agmatine deiminase expressed in Escherichia coli pre-incubated for 15 mins before agmatine substrate addition				Bioorg Med Chem 22: 4602-8 (2014) Article DOI: 10.1016/j.bmc.2014.07.028 BindingDB Entry DOI: 10.7270/Q2Z039SG
					More data for this Ligand-Target Pair