BDBM50308299 (S)-N-(4-Fluorophenyl)-7-(2-(hydroxyamino)-2-oxoethoxy)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide hydrochloride::CHEMBL596603

SMILES: ONC(=O)COc1ccc2C[C@H](NCc2c1)C(=O)Nc1ccc(F)cc1

InChI Key: InChIKey=PWLNUYVAVOBDEP-INIZCTEOSA-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 = 50308299   

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 8 (Homo sapiens (Human))	BDBM50308299 ((S)-N-(4-Fluorophenyl)-7-(2-(hydroxyamino)-2-oxoet...) Show SMILES ONC(=O)COc1ccc2C[C@H](NCc2c1)C(=O)Nc1ccc(F)cc1 |r| Show InChI InChI=1S/C18H18FN3O4/c19-13-2-4-14(5-3-13)21-18(24)16-8-11-1-6-15(7-12(11)9-20-16)26-10-17(23)22-25/h1-7,16,20,25H,8-10H2,(H,21,24)(H,22,23)/t16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.23E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of HDAC8 expressed in Escherichia coli assessed as Boc-Lys (acetyl)-AMC substrate hydrolysis by fluorimetric assay				Bioorg Med Chem 18: 1761-72 (2010) Article DOI: 10.1016/j.bmc.2010.01.060 BindingDB Entry DOI: 10.7270/Q2JD4WX3
					More data for this Ligand-Target Pair