BindingDB logo
myBDB logout

BDBM50211929 CHEMBL390063::methyl 6-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)hexanoate

SMILES: CCc1ccc(\C=C2/SC(=S)N(CCCCCC(=O)OC)C2=O)cc1

InChI Key: InChIKey=YGUGWXLWFQCVPF-SSZFMOIBSA-N

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 = 50211929   
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
Enoyl-acyl-carrier protein reductase


(Plasmodium falciparum)
BDBM50211929
PNG
(CHEMBL390063 | methyl 6-(5-(4-ethylbenzylidene)-4-...)
Show SMILES CCc1ccc(\C=C2/SC(=S)N(CCCCCC(=O)OC)C2=O)cc1
Show InChI InChI=1S/C19H23NO3S2/c1-3-14-8-10-15(11-9-14)13-16-18(22)20(19(24)25-16)12-6-4-5-7-17(21)23-2/h8-11,13H,3-7,12H2,1-2H3/b16-13-
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Institute of Science

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum recombinant enoyl ACP reductase expressed in BL21 (DE3) cells


J Med Chem 50: 2665-75 (2007)


Article DOI: 10.1021/jm061257w
BindingDB Entry DOI: 10.7270/Q2ZP46X9
More data for this
Ligand-Target Pair