Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Falcipain 2' and Ligand = 'BDBM50461272'   

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
Falcipain 2 (Plasmodium falciparum)	BDBM50461272 (CHEMBL4227031) Show SMILES CN1CCN(Cc2ccc(cc2)-c2cncc(c2)C(=O)N[C@@H](Cc2cccnc2)C(=O)NC2(CC2)C#N)CC1 |r| Show InChI InChI=1S/C30H33N7O2/c1-36-11-13-37(14-12-36)20-22-4-6-24(7-5-22)25-16-26(19-33-18-25)28(38)34-27(15-23-3-2-10-32-17-23)29(39)35-30(21-31)8-9-30/h2-7,10,16-19,27H,8-9,11-15,20H2,1H3,(H,34,38)(H,35,39)/t27-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40	n/a	n/a	n/a	n/a	n/a	n/a
IRBM Science Park Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-2				Bioorg Med Chem Lett 28: 1540-1544 (2018) Article DOI: 10.1016/j.bmcl.2018.03.069 BindingDB Entry DOI: 10.7270/Q2G44SW1
					More data for this Ligand-Target Pair