BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Plasmepsin II' and Ligand = 'BDBM50513836'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Plasmepsin II


(Plasmodium falciparum)		BDBM50513836
PNG
(CHEMBL4536043)
Show SMILES CC(C)c1ccccc1OCCc1ccc(cc1)C1=C(C2CN(CC(C1)N2)C(C)=O)C(=O)N(C)CCc1ccccc1 |t:20|
Show InChI InChI=1S/C36H43N3O3/c1-25(2)31-12-8-9-13-34(31)42-21-19-28-14-16-29(17-15-28)32-22-30-23-39(26(3)40)24-33(37-30)35(32)36(41)38(4)20-18-27-10-6-5-7-11-27/h5-17,25,30,33,37H,18-24H2,1-4H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 10n/an/an/an/an/an/a



Latvian Institute of Organic Synthesis

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum plasmepsin 2 using Dabcyl-ERNIef:LSFP-EDANS as substrate incubated for 40 mins by FRET assay

J Med Chem 62: 8931-8950 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00184
BindingDB Entry DOI: 10.7270/Q2P55RVR
More data for this
Ligand-Target Pair