BDBM50385005 CHEMBL2035380

SMILES: Nc1ccccc1NC(=O)CCCNCC(=O)Nc1ccccc1[N+]([O-])=O

InChI Key: InChIKey=YFJIBEROUJNHFA-UHFFFAOYSA-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 = 50385005   

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))	BDBM50385005 (CHEMBL2035380) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1ccccc1[N+]([O-])=O Show InChI InChI=1S/C18H21N5O4/c19-13-6-1-2-7-14(13)21-17(24)10-5-11-20-12-18(25)22-15-8-3-4-9-16(15)23(26)27/h1-4,6-9,20H,5,10-12,19H2,(H,21,24)(H,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair