null

SMILES: O=C(N[C@@H](CCCCCCSSc1ccccn1)C(=O)OCc1cccc2ccccc12)OCc1ccccc1

InChI Key: InChIKey=TZAABCIWJURFOM-LJAQVGFWSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50381678   

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 1 (Homo sapiens (Human))	BDBM50381678 (CHEMBL2022833) Show SMILES O=C(N[C@@H](CCCCCCSSc1ccccn1)C(=O)OCc1cccc2ccccc12)OCc1ccccc1 |r| Show InChI InChI=1S/C32H34N2O4S2/c35-31(37-24-27-17-12-16-26-15-7-8-18-28(26)27)29(34-32(36)38-23-25-13-4-3-5-14-25)19-6-1-2-11-22-39-40-30-20-9-10-21-33-30/h3-5,7-10,12-18,20-21,29H,1-2,6,11,19,22-24H2,(H,34,36)/t29-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	64.7	n/a	n/a	n/a	n/a	n/a	n/a
Dalian University of Technology Curated by ChEMBL					Assay Description Inhibition of human HDAC1 in presence of dithiothreitol by HDAC fluorescent assay				Eur J Med Chem 52: 111-22 (2012) Article DOI: 10.1016/j.ejmech.2012.03.009 BindingDB Entry DOI: 10.7270/Q23R0TV8
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM50381678 (CHEMBL2022833) Show SMILES O=C(N[C@@H](CCCCCCSSc1ccccn1)C(=O)OCc1cccc2ccccc12)OCc1ccccc1 |r| Show InChI InChI=1S/C32H34N2O4S2/c35-31(37-24-27-17-12-16-26-15-7-8-18-28(26)27)29(34-32(36)38-23-25-13-4-3-5-14-25)19-6-1-2-11-22-39-40-30-20-9-10-21-33-30/h3-5,7-10,12-18,20-21,29H,1-2,6,11,19,22-24H2,(H,34,36)/t29-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	39.6	n/a	n/a	n/a	n/a	n/a	n/a
Dalian University of Technology Curated by ChEMBL					Assay Description Inhibition of HDAC2 in human HeLa cell nuclear extracts in presence of dithiothreitol by HDAC fluorescent assay				Eur J Med Chem 52: 111-22 (2012) Article DOI: 10.1016/j.ejmech.2012.03.009 BindingDB Entry DOI: 10.7270/Q23R0TV8
					More data for this Ligand-Target Pair