BDBM50479649 CHEMBL480378

SMILES: CN(c1ccc(cc1)C(=O)CSC(C)=O)S(=O)(=O)c1ccc(OC(F)(F)F)cc1

InChI Key: InChIKey=XTMZURQRKWPPHT-UHFFFAOYSA-N

Data: 1 EC50

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 = 50479649   

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
Histone deacetylase (Homo sapiens (Human))	BDBM50479649 (CHEMBL480378) Show SMILES CN(c1ccc(cc1)C(=O)CSC(C)=O)S(=O)(=O)c1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C18H16F3NO5S2/c1-12(23)28-11-17(24)13-3-5-14(6-4-13)22(2)29(25,26)16-9-7-15(8-10-16)27-18(19,20)21/h3-10H,11H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a
Kalypsys Inc Curated by ChEMBL					Assay Description Inhibition of histone deacetylase in human HeLa cells assessed as induction of histone H3 hyperacetylation				Bioorg Med Chem Lett 18: 6482-5 (2008) Article DOI: 10.1016/j.bmcl.2008.10.058 BindingDB Entry DOI: 10.7270/Q2G44T2P
					More data for this Ligand-Target Pair