Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Metacaspase-2' and Ligand = 'BDBM50313779'   

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
Metacaspase-2 (Trypanosoma brucei)	BDBM50313779 ((S)-benzyl 1-cyano-4-guanidinobutylcarbamate | CHE...) Show SMILES [#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1)C#N |r| Show InChI InChI=1S/C14H19N5O2/c15-9-12(7-4-8-18-13(16)17)19-14(20)21-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-8,10H2,(H,19,20)(H4,16,17,18)/t12-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Antwerp Curated by ChEMBL					Assay Description Inhibition of Trypanosoma brucei MAC2				Bioorg Med Chem Lett 20: 2001-6 (2010) Article DOI: 10.1016/j.bmcl.2010.01.099 BindingDB Entry DOI: 10.7270/Q2BG2P5T
					More data for this Ligand-Target Pair