Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thermolysin' and Ligand = 'BDBM50025915'   

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
Thermolysin (Bacillus thermoproteolyticus)	BDBM50025915 (CHEMBL16622 | [2-Benzyl-3-(formyl-hydroxy-amino)-p...) Show SMILES ON(CC(Cc1ccccc1)C(=O)NCC(O)=O)C=O Show InChI InChI=1S/C13H16N2O5/c16-9-15(20)8-11(13(19)14-7-12(17)18)6-10-4-2-1-3-5-10/h1-5,9,11,20H,6-8H2,(H,14,19)(H,17,18)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	3.40E+4	n/a	n/a	n/a	n/a	n/a	n/a	7.2	n/a
Pohang University of Science and Technology Curated by ChEMBL					Assay Description Inhibitory activity against thermolysin using 2-furylacryloyl-Gly-Leu-NH2 as substrate at pH 7.2				Bioorg Med Chem Lett 8: 323-6 (1999) BindingDB Entry DOI: 10.7270/Q2WM1CJ0
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