BDBM50197157 CHEMBL3976805

SMILES: COc1ccc(cc1)-c1nnc(CNC(=O)[C@@H](C)N)o1

InChI Key: InChIKey=MGQXCWPDPCCUML-MRVPVSSYSA-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 = 50197157   

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))	BDBM50197157 (CHEMBL3976805) Show SMILES COc1ccc(cc1)-c1nnc(CNC(=O)[C@@H](C)N)o1 |r| Show InChI InChI=1S/C13H16N4O3/c1-8(14)12(18)15-7-11-16-17-13(20-11)9-3-5-10(19-2)6-4-9/h3-6,8H,7,14H2,1-2H3,(H,15,18)/t8-/m1/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	153	n/a	n/a	n/a	n/a	n/a	n/a
Acharya Nagarjuna University Curated by ChEMBL					Assay Description Inhibition of recombinant human full length GST-tagged HDAC8 expressed in Escherichia coli DH5alpha (DE3) assessed as inhibition of deacetylation act...				Bioorg Med Chem 24: 5611-5617 (2016) Article DOI: 10.1016/j.bmc.2016.09.022 BindingDB Entry DOI: 10.7270/Q2X06900
					More data for this Ligand-Target Pair