Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Glandular kallikrein' and Ligand = 'BDBM50016539'   

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
Glandular kallikrein (Sus scrofa)	BDBM50016539 (CHEMBL3277936) Show SMILES Cl.NC(=N)c1cccc(OCc2cccc(c2)-c2cccc(COc3cccc(c3)C(N)=N)c2)c1 Show InChI InChI=1S/C28H26N4O2.ClH/c29-27(30)23-9-3-11-25(15-23)33-17-19-5-1-7-21(13-19)22-8-2-6-20(14-22)18-34-26-12-4-10-24(16-26)28(31)32;/h1-16H,17-18H2,(H3,29,30)(H3,31,32);1H	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.76E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic kallikrein using BANA as substrate after 15 to 180 mins				J Med Chem 19: 634-9 (1976) BindingDB Entry DOI: 10.7270/Q2KD20FM
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