BDBM50356641 CHEMBL1914707

SMILES: ONC(=O)CCCCCCC(=O)Nc1cnn(Cc2ccc(NC(=O)c3cc(CN=[N+]=[N-])cc(c3)N=[N+]=[N-])cc2)c1

InChI Key: InChIKey=PNUBCQKQJHDDEQ-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 = 50356641   

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))	BDBM50356641 (CHEMBL1914707) Show SMILES ONC(=O)CCCCCCC(=O)Nc1cnn(Cc2ccc(NC(=O)c3cc(CN=[N+]=[N-])cc(c3)N=[N+]=[N-])cc2)c1 Show InChI InChI=1S/C26H29N11O4/c27-35-29-14-19-11-20(13-22(12-19)33-36-28)26(40)32-21-9-7-18(8-10-21)16-37-17-23(15-30-37)31-24(38)5-3-1-2-4-6-25(39)34-41/h7-13,15,17,41H,1-6,14,16H2,(H,31,38)(H,32,40)(H,34,39)	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	487	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC8 using Fluor de Lys as substrate				J Med Chem 54: 4350-64 (2011) Article DOI: 10.1021/jm2001025 BindingDB Entry DOI: 10.7270/Q2RX9CG0
					More data for this Ligand-Target Pair
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2) (Homo sapiens (Human))	BDBM50356641 (CHEMBL1914707) Show SMILES ONC(=O)CCCCCCC(=O)Nc1cnn(Cc2ccc(NC(=O)c3cc(CN=[N+]=[N-])cc(c3)N=[N+]=[N-])cc2)c1 Show InChI InChI=1S/C26H29N11O4/c27-35-29-14-19-11-20(13-22(12-19)33-36-28)26(40)32-21-9-7-18(8-10-21)16-37-17-23(15-30-37)31-24(38)5-3-1-2-4-6-25(39)34-41/h7-13,15,17,41H,1-6,14,16H2,(H,31,38)(H,32,40)(H,34,39)	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	432	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Chicago Curated by ChEMBL					Assay Description Inhibition of human recombinant HDAC3/NCoR2 using fluorophore-conjugated substrate Boc-L-Lys(Ac)-AMC				J Med Chem 54: 4350-64 (2011) Article DOI: 10.1021/jm2001025 BindingDB Entry DOI: 10.7270/Q2RX9CG0
					More data for this Ligand-Target Pair