BDBM8448 2-[(5Z)-4-oxo-2-sulfanylidene-5-(1,3-thiazol-2-ylmethylidene)-1,3-thiazolidin-3-yl]acetic acid::Rhodanine-thiazole analogue 13

SMILES: OC(=O)CN1C(=S)S\C(=C/c2nccs2)C1=O

InChI Key: InChIKey=NXNJQVJDNPNFES-HYXAFXHYSA-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 = 8448   

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
Anthrax Lethal Factor (LF) (Bacillus anthracis)	BDBM8448 (2-[(5Z)-4-oxo-2-sulfanylidene-5-(1,3-thiazol-2-ylm...) Show SMILES OC(=O)CN1C(=S)S\C(=C/c2nccs2)C1=O Show InChI InChI=1S/C9H6N2O3S3/c12-7(13)4-11-8(14)5(17-9(11)15)3-6-10-1-2-16-6/h1-3H,4H2,(H,12,13)/b5-3-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	7.24E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Institute for Medical Research					Assay Description Fluorescence peptide cleavage assay was performed in a 96-well plate. Each reaction contained MAPKKide, LF, and the small-molecule inhibitor. The C-t...				Proc Natl Acad Sci U S A 102: 9499-504 (2005) Article DOI: 10.1073/pnas.0502733102 BindingDB Entry DOI: 10.7270/Q2TM78BQ
					More data for this Ligand-Target Pair