BDBM50156682 CHEMBL3794384

SMILES: O=C(CCS\C=C\c1ccccc1)NCCSCc1ccco1

InChI Key: InChIKey=JHWCQUVVQNLKEX-XYOKQWHBSA-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 = 50156682   

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))	BDBM50156682 (CHEMBL3794384) Show SMILES O=C(CCS\C=C\c1ccccc1)NCCSCc1ccco1 Show InChI InChI=1S/C18H21NO2S2/c20-18(19-10-14-23-15-17-7-4-11-21-17)9-13-22-12-8-16-5-2-1-3-6-16/h1-8,11-12H,9-10,13-15H2,(H,19,20)/b12-8+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sungkyunkwan University Curated by ChEMBL					Assay Description Inhibition of HDAC in human HeLa cells using fluor de Lys as substrate incubated for 20 mins by microplate spectrofluorometric analysis				Eur J Med Chem 116: 126-135 (2016) BindingDB Entry DOI: 10.7270/Q2057HTZ
					More data for this Ligand-Target Pair