BDBM50033702 CHEMBL3358135

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)N[C@@H](C)C(=O)Nc1nccs1

InChI Key: InChIKey=MVHRPYDAWTWALI-ZGBNHBFISA-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 = 50033702   

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)	BDBM50033702 (CHEMBL3358135) 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)N[C@@H](C)C(=O)Nc1nccs1 |r| Show InChI InChI=1S/C30H51N7O5S/c1-17(2)15-22(34-28(41)23(16-18(3)4)35-29(42)25(19(5)6)37(9)10)27(40)32-20(7)11-12-24(38)33-21(8)26(39)36-30-31-13-14-43-30/h11-14,17-23,25H,15-16H2,1-10H3,(H,32,40)(H,33,38)(H,34,41)(H,35,42)(H,31,36,39)/p+1/b12-11+/t20-,21-,22-,23-,25-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+3	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