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
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Enoyl-acyl-carrier protein reductase (Plasmodium falciparum) | BDBM50174768 (5‐chloro‐2‐(2‐chloro‐...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/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 Structure (docked) | ||||||||||||
Enoyl-acyl carrier reductase (Toxoplasma gondii) | BDBM50174768 (5‐chloro‐2‐(2‐chloro‐...) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 3 | n/a | n/a | n/a | n/a | 7.5 | n/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 |