BDBM50390439 CHEMBL2071368

SMILES: COc1cccc(c1)-n1cnc2sc3CCCCc3c2c1=O

InChI Key: InChIKey=IEUWVPDNWQUZLW-UHFFFAOYSA-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 = 50390439   

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
Intracellular chorismate mutase (Mycobacterium tuberculosis)	BDBM50390439 (CHEMBL2071368) Show SMILES COc1cccc(c1)-n1cnc2sc3CCCCc3c2c1=O Show InChI InChI=1S/C17H16N2O2S/c1-21-12-6-4-5-11(9-12)19-10-18-16-15(17(19)20)13-7-2-3-8-14(13)22-16/h4-6,9-10H,2-3,7-8H2,1H3	PDB MMDB KEGG B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.98E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Hyderabad Campus Curated by ChEMBL					Assay Description Inhibition of Mycobacterium tuberculosis chorismate mutase using chorismate substrate in dose response study by spectrophotometry				Bioorg Med Chem 20: 5127-38 (2012) Article DOI: 10.1016/j.bmc.2012.07.011 BindingDB Entry DOI: 10.7270/Q21837KB
					More data for this Ligand-Target Pair