BDBM50020164 CHEMBL3288475

SMILES: Cc1ccc(cc1)-c1csc(NC(=O)CCCCCCS)n1

InChI Key: InChIKey=CYQGDLYBYHOZHO-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 = 50020164   

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 9 (Homo sapiens (Human))	BDBM50020164 (CHEMBL3288475) Show SMILES Cc1ccc(cc1)-c1csc(NC(=O)CCCCCCS)n1 Show InChI InChI=1S/C17H22N2OS2/c1-13-7-9-14(10-8-13)15-12-22-17(18-15)19-16(20)6-4-2-3-5-11-21/h7-10,12,21H,2-6,11H2,1H3,(H,18,19,20)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya University Curated by ChEMBL					Assay Description Inhibition of human HDAC9 by HDAC-Glo assay				ACS Med Chem Lett 5: 582-6 (2014) Article DOI: 10.1021/ml500024s BindingDB Entry DOI: 10.7270/Q2Z3217N
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50020164 (CHEMBL3288475) Show SMILES Cc1ccc(cc1)-c1csc(NC(=O)CCCCCCS)n1 Show InChI InChI=1S/C17H22N2OS2/c1-13-7-9-14(10-8-13)15-12-22-17(18-15)19-16(20)6-4-2-3-5-11-21/h7-10,12,21H,2-6,11H2,1H3,(H,18,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya University Curated by ChEMBL					Assay Description Inhibition of human HDAC1 by HDAC-Glo assay				ACS Med Chem Lett 5: 582-6 (2014) Article DOI: 10.1021/ml500024s BindingDB Entry DOI: 10.7270/Q2Z3217N
					More data for this Ligand-Target Pair