BDBM120944 US8716285, 1

SMILES: ONC(=O)c1ccc2CCC(Cc2c1)Nc1ccc(F)cc1

InChI Key: InChIKey=ZDMFHFPYBPYLCX-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 = 120944   

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
Cereblon/Histone deacetylase 6 (Homo sapiens (Human))	BDBM120944 (US8716285, 1) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1ccc(F)cc1 Show InChI InChI=1S/C17H17FN2O2/c18-14-4-7-15(8-5-14)19-16-6-3-11-1-2-12(17(21)20-22)9-13(11)10-16/h1-2,4-5,7-9,16,19,22H,3,6,10H2,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.25E+4	n/a	n/a	n/a	n/a
Roche Pharmaceutical Research and Early Development Curated by ChEMBL					Assay Description Inhibition of HDAC6 in human A549 cells assessed as tubulin acetylation after 17 to 18 hrs by cytoblot assay				J Med Chem 57: 8026-34 (2014) Article DOI: 10.1021/jm5008962 BindingDB Entry DOI: 10.7270/Q29C700V
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120944 (US8716285, 1) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1ccc(F)cc1 Show InChI InChI=1S/C17H17FN2O2/c18-14-4-7-15(8-5-14)19-16-6-3-11-1-2-12(17(21)20-22)9-13(11)10-16/h1-2,4-5,7-9,16,19,22H,3,6,10H2,(H,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.68E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair