Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Thermolysin' and Ligand = 'BDBM50321121'   

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)	BDBM50321121 (CHEMBL1163684 | EthanimidicacidN-[4-oxo-2-phenyl-3...) Show SMILES COC(C)=Nn1c(nc2ccccc2c1=O)-c1ccccc1 |w:4.4| Show InChI InChI=1S/C17H15N3O2/c1-12(22-2)19-20-16(13-8-4-3-5-9-13)18-15-11-7-6-10-14(15)17(20)21/h3-11H,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.06E+8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Troms£ Curated by ChEMBL					Assay Description Inhibition of Bacillus thermoproteolyticus thermolysin after 15 mins by microplate fluorescence analysis in presence of 0.5 to 2 mM substrate FaGLa				Bioorg Med Chem 18: 4317-27 (2010) Article DOI: 10.1016/j.bmc.2010.04.083 BindingDB Entry DOI: 10.7270/Q2QV3MP9
					More data for this Ligand-Target Pair
Thermolysin (Bacillus thermoproteolyticus)	BDBM50321121 (CHEMBL1163684 | EthanimidicacidN-[4-oxo-2-phenyl-3...) Show SMILES COC(C)=Nn1c(nc2ccccc2c1=O)-c1ccccc1 |w:4.4| Show InChI InChI=1S/C17H15N3O2/c1-12(22-2)19-20-16(13-8-4-3-5-9-13)18-15-11-7-6-10-14(15)17(20)21/h3-11H,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.23E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Troms£ Curated by ChEMBL					Assay Description Inhibition of Bacillus thermoproteolyticus thermolysin after 15 mins by microplate fluorescence analysis in presence of 0.1 M substrate FaGLa				Bioorg Med Chem 18: 4317-27 (2010) Article DOI: 10.1016/j.bmc.2010.04.083 BindingDB Entry DOI: 10.7270/Q2QV3MP9
					More data for this Ligand-Target Pair