BDBM50033626 CHEMBL3358144

SMILES: [O-]C(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)[NH+](C)C)C(=O)N[C@@H](C)\C=C\C(=O)N1CC(OCc2ccccc2)=CC1=O

InChI Key: InChIKey=MEUAKKXDWKGZKJ-BTXSMLBBSA-O

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50033626   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Falcipain-2 (Plasmodium falciparum)	BDBM50033626 (CHEMBL3358144) Show SMILES [O-]C(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)[NH+](C)C)C(=O)N[C@@H](C)\C=C\C(=O)N1CC(OCc2ccccc2)=CC1=O |r,c:49| Show InChI InChI=1S/C35H53N5O6/c1-22(2)17-28(37-34(44)29(18-23(3)4)38-35(45)32(24(5)6)39(8)9)33(43)36-25(7)15-16-30(41)40-20-27(19-31(40)42)46-21-26-13-11-10-12-14-26/h10-16,19,22-25,28-29,32H,17-18,20-21H2,1-9H3,(H,36,43)(H,37,44)(H,38,45)/p+1/b16-15+/t25-,28-,29-,32-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.60	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum FP2 using Z-Phe-Arg-AMC as substrate incubated for 30 mins prior to substrate addition measured after 30 mins by ...				J Med Chem 57: 10557-63 (2014) Article DOI: 10.1021/jm501439w BindingDB Entry DOI: 10.7270/Q2TM7CQW
					More data for this Ligand-Target Pair