BDBM50156681 CHEMBL3794274

SMILES: Cc1ncsc1CCn1cc(NC(=O)CCS\C=C/c2ccccc2)cn1

InChI Key: InChIKey=OFCZZOHNBQVHDC-FLIBITNWSA-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 = 50156681   

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))	BDBM50156681 (CHEMBL3794274) Show SMILES Cc1ncsc1CCn1cc(NC(=O)CCS\C=C/c2ccccc2)cn1 Show InChI InChI=1S/C20H22N4OS2/c1-16-19(27-15-21-16)7-10-24-14-18(13-22-24)23-20(25)9-12-26-11-8-17-5-3-2-4-6-17/h2-6,8,11,13-15H,7,9-10,12H2,1H3,(H,23,25)/b11-8-	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	2.98E+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