Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stromelysin-1' and Ligand = 'BDBM50084224'   

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))	BDBM50084224 ((R)-1-(4-Butoxy-benzenesulfonyl)-4-[(Z)-morpholin-...) Show SMILES CCCCOc1ccc(cc1)S(=O)(=O)N1C=C(C[C@@H]1C(=O)NO)NN1CCOCC1 |c:16| Show InChI InChI=1S/C19H28N4O6S/c1-2-3-10-29-16-4-6-17(7-5-16)30(26,27)23-14-15(13-18(23)19(24)21-25)20-22-8-11-28-12-9-22/h4-7,14,18,20,25H,2-3,8-13H2,1H3,(H,21,24)/t18-/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	2	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description In vitro inhibition activity of human recombinant stromelysin (Matrix metalloproteinase-3)				J Med Chem 42: 5426-36 (2000) BindingDB Entry DOI: 10.7270/Q2Q23ZGT
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