BDBM50308307 (S)-7-(2-(Hydroxyamino)-2-oxoethoxy)-N-(naphthalen-1-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide hydrochloride::CHEMBL597999

SMILES: ONC(=O)COc1ccc2C[C@H](NCc2c1)C(=O)Nc1cccc2ccccc12

InChI Key: InChIKey=QCYPIPLJTHSTEU-FQEVSTJZSA-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 = 50308307   

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))	BDBM50308307 ((S)-7-(2-(Hydroxyamino)-2-oxoethoxy)-N-(naphthalen...) Show SMILES ONC(=O)COc1ccc2C[C@H](NCc2c1)C(=O)Nc1cccc2ccccc12 |r| Show InChI InChI=1S/C22H21N3O4/c26-21(25-28)13-29-17-9-8-15-11-20(23-12-16(15)10-17)22(27)24-19-7-3-5-14-4-1-2-6-18(14)19/h1-10,20,23,28H,11-13H2,(H,24,27)(H,25,26)/t20-/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	1.06E+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