Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 318.3 BDBM50521947

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

Found 2 hits 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
Arginase (Leishmania amazonensis)	BDBM50521947 (CHEMBL4530523) Show SMILES CC(=O)Nc1ccccc1C(F)(F)C(=O)NCc1ccccc1 Show InChI InChI=1S/C17H16F2N2O2/c1-12(22)21-15-10-6-5-9-14(15)17(18,19)16(23)20-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,20,23)(H,21,22)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio de Janeiro Curated by ChEMBL					Assay Description Competitive inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production by measu...				Bioorg Med Chem 27: 3853-3859 (2019) Article DOI: 10.1016/j.bmc.2019.07.022 BindingDB Entry DOI: 10.7270/Q27D2ZJF
					More data for this Ligand-Target Pair
Arginase (Leishmania amazonensis)	BDBM50521947 (CHEMBL4530523) Show SMILES CC(=O)Nc1ccccc1C(F)(F)C(=O)NCc1ccccc1 Show InChI InChI=1S/C17H16F2N2O2/c1-12(22)21-15-10-6-5-9-14(15)17(18,19)16(23)20-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,20,23)(H,21,22)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal do Rio de Janeiro Curated by ChEMBL					Assay Description Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production using L-arginine as ...				Bioorg Med Chem 27: 3853-3859 (2019) Article DOI: 10.1016/j.bmc.2019.07.022 BindingDB Entry DOI: 10.7270/Q27D2ZJF
					More data for this Ligand-Target Pair