Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50070452'   

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
Stromelysin-1 (Homo sapiens (Human))	BDBM50070452 ((2S,3R)-2-Allyl-N*4*-((S)-2,2-dimethyl-1-methylcar...) Show SMILES CNC(=O)[C@@H](NC(=O)[C@H](CC(C)C)[C@](C)(CC=C)C(=O)NO)C(C)(C)C Show InChI InChI=1S/C19H35N3O4/c1-9-10-19(7,17(25)22-26)13(11-12(2)3)15(23)21-14(16(24)20-8)18(4,5)6/h9,12-14,26H,1,10-11H2,2-8H3,(H,20,24)(H,21,23)(H,22,25)/t13-,14+,19-/m0/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	480	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of Matrix metalloproteinase-3(MMP-3)				Bioorg Med Chem Lett 8: 1443-8 (1999) BindingDB Entry DOI: 10.7270/Q2DF6QB8
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