BDBM128082 US8796330, 146

SMILES: ONC(=O)\C=C\c1ccc(NC(=O)Nc2cccc3ccccc23)cc1

InChI Key: InChIKey=GTMJPAVGSFWBDU-JLHYYAGUSA-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 = 128082   

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 1 (Homo sapiens (Human))	BDBM128082 (US8796330, 146) Show SMILES ONC(=O)\C=C\c1ccc(NC(=O)Nc2cccc3ccccc23)cc1 Show InChI InChI=1S/C20H17N3O3/c24-19(23-26)13-10-14-8-11-16(12-9-14)21-20(25)22-18-7-3-5-15-4-1-2-6-17(15)18/h1-13,26H,(H,23,24)(H2,21,22,25)/b13-10+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	37
Methylgene Inc. US Patent					Assay Description For deacetylase assays, 20,000 cpm of the [3H]-metabolically labeled acetylated histone substrate (M. Yoshida et al., J. Biol. Chem. 265(28): 17174-1...				US Patent US8796330 (2014) BindingDB Entry DOI: 10.7270/Q22B8WQW
					More data for this Ligand-Target Pair