Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neutrophil elastase' and Ligand = 'BDBM50212647'   

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
Neutrophil elastase (Homo sapiens (Human))	BDBM50212647 (CHEMBL75236) Show SMILES CC[C@@H]1[C@H](Oc2ccc(cc2)C(O)=O)N(C(=O)NCc2ccccc2)C1=O Show InChI InChI=1S/C20H20N2O5/c1-2-16-17(23)22(20(26)21-12-13-6-4-3-5-7-13)18(16)27-15-10-8-14(9-11-15)19(24)25/h3-11,16,18H,2,12H2,1H3,(H,21,26)(H,24,25)/t16-,18-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars		n/a	n/a	n/a	n/a	n/a	n/a	5.60	n/a	n/a
TBA					Assay Description Compound was evaluated for the inhibitory activity against Human leukocyte elastase; time-dependent inhibition was not observed				Citation and Details BindingDB Entry DOI: 10.7270/Q2V69MR5
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