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BDBM50174768 5‐chloro‐2‐(2‐chloro‐4‐hydroxyphenoxy)phenol (5)::5-chloro-2-(2-chloro-4-hydroxyphenoxy)phenol::CHEMBL200379

SMILES: Oc1ccc(Oc2ccc(Cl)cc2O)c(Cl)c1

InChI Key: InChIKey=JVFMLMMBAJXPOQ-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50174768   
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)
BDBM50174768
PNG
(5‐chloro‐2‐(2‐chloro‐...)
Show SMILES Oc1ccc(Oc2ccc(Cl)cc2O)c(Cl)c1
Show InChI InChI=1S/C12H8Cl2O3/c13-7-1-3-12(10(16)5-7)17-11-4-2-8(15)6-9(11)14/h1-6,15-16H
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 220n/an/an/an/an/an/a



Princ

Curated by ChEMBL


Assay Description
Inhibition of PfENR enzymatic activity


Bioorg Med Chem Lett 15: 5247-52 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.044
BindingDB Entry DOI: 10.7270/Q2NC60RF
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50174768
PNG
(5‐chloro‐2‐(2‐chloro‐...)
Show SMILES Oc1ccc(Oc2ccc(Cl)cc2O)c(Cl)c1
Show InChI InChI=1S/C12H8Cl2O3/c13-7-1-3-12(10(16)5-7)17-11-4-2-8(15)6-9(11)14/h1-6,15-16H
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 3n/an/an/an/a7.5n/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Biochemistry 52: 9155-66 (2013)


Article DOI: 10.1021/bi400945y
BindingDB Entry DOI: 10.7270/Q2PV6J27
More data for this
Ligand-Target Pair