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BDBM50415541 CHEMBL597017

SMILES: COc1ccc(C(=O)\C=C\c2ccc(OCC#C)cc2)c(OC)c1OC

InChI Key: InChIKey=FITGPSUYSCFUMG-XYOKQWHBSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50415541   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Falcipain-2


(Plasmodium falciparum)
BDBM50415541
PNG
(CHEMBL597017)
Show SMILES COc1ccc(C(=O)\C=C\c2ccc(OCC#C)cc2)c(OC)c1OC
Show InChI InChI=1S/C21H20O5/c1-5-14-26-16-9-6-15(7-10-16)8-12-18(22)17-11-13-19(23-2)21(25-4)20(17)24-3/h1,6-13H,14H2,2-4H3/b12-8+
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Cape Town

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum falcipain-2


Bioorg Med Chem Lett 20: 942-4 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.062
BindingDB Entry DOI: 10.7270/Q26M383G
More data for this
Ligand-Target Pair