BDBM50400320 CHEMBL2181509

SMILES: CC(CS(=O)(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1

InChI Key: InChIKey=MXRNEBGFCGOTKX-WPWMEQJKSA-N

Data: 2 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 2 hits for monomerid = 50400320   

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
NAD-Dependent Deacetylase Sirtuin-1 (Homo sapiens (Human))	BDBM50400320 (CHEMBL2181509) Show SMILES CC(CS(=O)(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H23NO3S/c1-19(20-9-3-2-4-10-20)18-31(29,30)26-14-8-7-13-24(26)27-17-23-22-12-6-5-11-21(22)15-16-25(23)28/h2-17,19,28H,18H2,1H3/b27-17+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent deacetylase sirtuin 2 (Homo sapiens (Human))	BDBM50400320 (CHEMBL2181509) Show SMILES CC(CS(=O)(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H23NO3S/c1-19(20-9-3-2-4-10-20)18-31(29,30)26-14-8-7-13-24(26)27-17-23-22-12-6-5-11-21(22)15-16-25(23)28/h2-17,19,28H,18H2,1H3/b27-17+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human SIRT2 expressed in Escherichia coli using Gln-Pro-Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluorescence based assay				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair