Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Matrix metalloproteinase-9' and Ligand = 'BDBM50111997'   

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))	BDBM50111997 (CHEMBL366997 | N-[(S)-2-(4-Benzyloxy-phenyl)-1-met...) Show SMILES CNC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C(=O)NO Show InChI InChI=1S/C19H21N3O5/c1-20-17(23)16(21-18(24)19(25)22-26)11-13-7-9-15(10-8-13)27-12-14-5-3-2-4-6-14/h2-10,16,26H,11-12H2,1H3,(H,20,23)(H,21,24)(H,22,25)/t16-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bielefeld Curated by ChEMBL					Assay Description Inhibitory activity against human gelatinase B (matrix metalloproteinase-9)				Bioorg Med Chem Lett 12: 933-6 (2002) BindingDB Entry DOI: 10.7270/Q20V8C35
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