Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Plasmepsin II' and Ligand = 'BDBM50145183'   

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
Plasmepsin II (Plasmodium falciparum)	BDBM50145183 (CHEMBL3763489) Show SMILES Nc1nc2cc(ccc2c(=O)n1C[C@@H]1CC[C@@H](O1)c1ccccc1)-c1ccc(CCCCc2ccccc2)cc1 |r| Show InChI InChI=1S/C35H35N3O2/c36-35-37-32-23-29(27-17-15-26(16-18-27)12-8-7-11-25-9-3-1-4-10-25)19-21-31(32)34(39)38(35)24-30-20-22-33(40-30)28-13-5-2-6-14-28/h1-6,9-10,13-19,21,23,30,33H,7-8,11-12,20,22,24H2,(H2,36,37)/t30-,33+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Latvian Institute of Organic Synthesis Curated by ChEMBL					Assay Description Displacement of pepstatin A from recombinant Plasmodium falciparum plasmepsin 2 by NMR analysis				J Med Chem 59: 374-87 (2016) Article DOI: 10.1021/acs.jmedchem.5b01558 BindingDB Entry DOI: 10.7270/Q26975DP
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