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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cysteine proteinase falcipain 2a' and Ligand = 'BDBM50448257'   
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
Cysteine proteinase falcipain 2a


(Plasmodium falciparum)
BDBM50448257
PNG
(CHEMBL3120838)
Show SMILES CC(=O)OCC(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C31H32N2O6/c1-22(34)38-21-29(35)27(17-16-23-10-4-2-5-11-23)32-30(36)28-18-25-14-8-9-15-26(25)19-33(28)31(37)39-20-24-12-6-3-7-13-24/h2-15,27-28H,16-21H2,1H3,(H,32,36)/t27-,28-/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum cysteine protease falcipain-2


Bioorg Med Chem Lett 24: 1274-9 (2014)


Article DOI: 10.1016/j.bmcl.2014.01.062
BindingDB Entry DOI: 10.7270/Q26Q1ZRJ
More data for this
Ligand-Target Pair