BDBM50209968 (Z)-2-(4-chlorophenyl)-3-(4,5-dimethoxy-2-nitrophenyl)acrylic acid::CHEMBL232427

SMILES: COc1cc(\C=C(/C(O)=O)c2ccc(Cl)cc2)c(cc1OC)[N+]([O-])=O

InChI Key: InChIKey=GJOOVCUVZFWBJW-QPEQYQDCSA-N

Data: 1 KI

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 = 50209968   

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
Chorismate mutase (MTB CM) (Mycobacterium tuberculosis H37Rv)	BDBM50209968 ((Z)-2-(4-chlorophenyl)-3-(4,5-dimethoxy-2-nitrophe...) Show SMILES COc1cc(\C=C(/C(O)=O)c2ccc(Cl)cc2)c(cc1OC)[N+]([O-])=O Show InChI InChI=1S/C17H14ClNO6/c1-24-15-8-11(14(19(22)23)9-16(15)25-2)7-13(17(20)21)10-3-5-12(18)6-4-10/h3-9H,1-2H3,(H,20,21)/b13-7-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	1.77E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of chorismate mutase in Mycobacterium tuberculosis H37Rv strain				Bioorg Med Chem Lett 17: 3053-8 (2007) Article DOI: 10.1016/j.bmcl.2007.03.053 BindingDB Entry DOI: 10.7270/Q2028R7K
					More data for this Ligand-Target Pair