Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Matrix metalloproteinase-9' and Ligand = 'BDBM50106665'   

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))	BDBM50106665 (3-(Formyl-hydroxy-amino)-2-isobutyl-4-methyl-penta...) Show SMILES CC(C)C[C@H]([C@H](C(C)C)N(O)C=O)C(=O)N[C@@H](CCCN=C(N)NS(C)(=O)=O)C(=O)Nc1nccs1 |w:20.19| Show InChI InChI=1S/C21H37N7O6S2/c1-13(2)11-15(17(14(3)4)28(32)12-29)18(30)25-16(19(31)26-21-24-9-10-35-21)7-6-8-23-20(22)27-36(5,33)34/h9-10,12-17,32H,6-8,11H2,1-5H3,(H,25,30)(H3,22,23,27)(H,24,26,31)/t15-,16+,17+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition potency was determined by fluorescence-based peptide assay against matrix metalloprotease-9				J Med Chem 44: 4252-67 (2001) BindingDB Entry DOI: 10.7270/Q24J0DF5
					More data for this Ligand-Target Pair