BDBM50026459 CHEMBL3335307

SMILES: ONC(=O)CCCCc1ccn(Cc2ccc3ccccc3c2)n1

InChI Key: InChIKey=VRSKSLZJIOGLJB-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50026459   

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))	BDBM50026459 (CHEMBL3335307) Show SMILES ONC(=O)CCCCc1ccn(Cc2ccc3ccccc3c2)n1 Show InChI InChI=1S/C19H21N3O2/c23-19(21-24)8-4-3-7-18-11-12-22(20-18)14-15-9-10-16-5-1-2-6-17(16)13-15/h1-2,5-6,9-13,24H,3-4,7-8,14H2,(H,21,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC1 after 60 mins by fluorimetric assay				Eur J Med Chem 86: 639-52 (2014) Article DOI: 10.1016/j.ejmech.2014.09.024 BindingDB Entry DOI: 10.7270/Q2NV9KTB
					More data for this Ligand-Target Pair
Histone deacetylase 7 (Homo sapiens (Human))	BDBM50026459 (CHEMBL3335307) Show SMILES ONC(=O)CCCCc1ccn(Cc2ccc3ccccc3c2)n1 Show InChI InChI=1S/C19H21N3O2/c23-19(21-24)8-4-3-7-18-11-12-22(20-18)14-15-9-10-16-5-1-2-6-17(16)13-15/h1-2,5-6,9-13,24H,3-4,7-8,14H2,(H,21,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC7 after 60 mins by fluorimetric assay				Eur J Med Chem 86: 639-52 (2014) Article DOI: 10.1016/j.ejmech.2014.09.024 BindingDB Entry DOI: 10.7270/Q2NV9KTB
					More data for this Ligand-Target Pair