Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Matrix metalloproteinase-9' and Ligand = 'BDBM50402512'   

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
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50402512 (CHEMBL2204807) Show SMILES COc1ccc(CCN(CCC(=O)NO)S(=O)(=O)c2ccc(cc2)S(C)(=O)=O)cc1 Show InChI InChI=1S/C19H24N2O7S2/c1-28-16-5-3-15(4-6-16)11-13-21(14-12-19(22)20-23)30(26,27)18-9-7-17(8-10-18)29(2,24)25/h3-10,23H,11-14H2,1-2H3,(H,20,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
FibroGen Inc. Curated by ChEMBL					Assay Description Inhibition of para-amino phenylmercuric acetate-activated MMP9 using Mca-P-L-G-L-Dap(Dnp)-A-R-NH2 as substrate after 1 hr by fluorescence assay				Bioorg Med Chem Lett 22: 7397-401 (2012) Article DOI: 10.1016/j.bmcl.2012.10.067 BindingDB Entry DOI: 10.7270/Q22808SM
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