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SMILES: Cc1ccccc1-c1ccc(Oc2ccc(cc2Cl)C#N)c(O)c1

InChI Key: InChIKey=UELZHMTYGHATAK-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 25415   

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)	BDBM25415 (3-chloro-4-[2-hydroxy-4-(2-methylphenyl)phenoxy]be...) Show SMILES Cc1ccccc1-c1ccc(Oc2ccc(cc2Cl)C#N)c(O)c1 Show InChI InChI=1S/C20H14ClNO2/c1-13-4-2-3-5-16(13)15-7-9-20(18(23)11-15)24-19-8-6-14(12-22)10-17(19)21/h2-11,23H,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
International Centre for Science and High Technology Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum enoyl-acyl carrier protein reductase				Eur J Med Chem 44: 3009-19 (2009) Article DOI: 10.1016/j.ejmech.2008.12.028 BindingDB Entry DOI: 10.7270/Q20K28MM
					More data for this Ligand-Target Pair
Enoyl-ACP reductase (Plasmodium falciparum)	BDBM25415 (3-chloro-4-[2-hydroxy-4-(2-methylphenyl)phenoxy]be...) Show SMILES Cc1ccccc1-c1ccc(Oc2ccc(cc2Cl)C#N)c(O)c1 Show InChI InChI=1S/C20H14ClNO2/c1-13-4-2-3-5-16(13)15-7-9-20(18(23)11-15)24-19-8-6-14(12-22)10-17(19)21/h2-11,23H,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	7.9	25
Jacobus Pharmaceutical Company					Assay Description PfENR inhibition assays were carried out on a Cary 100 Bio Spectrophotometer or POLARstar Optima by monitoring oxidation of NADH at 340 nm. The IC50 ...				J Biol Chem 282: 25436-44 (2007) Article DOI: 10.1074/jbc.M701813200 BindingDB Entry DOI: 10.7270/Q22V2DFD
					More data for this Ligand-Target Pair