Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 302.3 BDBM50434214

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
Macrophage metalloelastase (Homo sapiens (Human))	BDBM50434214 (CHEMBL2385488) Show SMILES ONC(=O)CNS(=O)(=O)CCc1ccc2OCOc2c1 Show InChI InChI=1S/C11H14N2O6S/c14-11(13-15)6-12-20(16,17)4-3-8-1-2-9-10(5-8)19-7-18-9/h1-2,5,12,15H,3-4,6-7H2,(H,13,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Inhibition of MMP12 (unknown origin)-mediated Mca-Pro-Leu-Gly-Leu-Dpa-Ala-Arg-NH2 by fluorimetric assay				ACS Med Chem Lett 4: 565-9 (2013) Article DOI: 10.1021/ml300446a BindingDB Entry DOI: 10.7270/Q2B859HT
					More data for this Ligand-Target Pair
Matrilysin (Homo sapiens (Human))	BDBM50434214 (CHEMBL2385488) Show SMILES ONC(=O)CNS(=O)(=O)CCc1ccc2OCOc2c1 Show InChI InChI=1S/C11H14N2O6S/c14-11(13-15)6-12-20(16,17)4-3-8-1-2-9-10(5-8)19-7-18-9/h1-2,5,12,15H,3-4,6-7H2,(H,13,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.85E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florence Curated by ChEMBL					Assay Description Inhibition of MMP7 (unknown origin)-mediated Mca-Pro-Leu-Gly-Leu-Dpa-Ala-Arg-NH2 by fluorimetric assay				ACS Med Chem Lett 4: 565-9 (2013) Article DOI: 10.1021/ml300446a BindingDB Entry DOI: 10.7270/Q2B859HT
					More data for this Ligand-Target Pair