BDBM50512104 CHEMBL4562742

SMILES: ONC(=O)CCCOc1ccc(cc1)N1C(SCC1=O)c1ccc(Br)s1

InChI Key: InChIKey=KTCAVWOMVSVMGH-UHFFFAOYSA-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 = 50512104   

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
Cereblon/Histone deacetylase 1 (Homo sapiens (Human))	BDBM50512104 (CHEMBL4562742) Show SMILES ONC(=O)CCCOc1ccc(cc1)N1C(SCC1=O)c1ccc(Br)s1 Show InChI InChI=1S/C17H17BrN2O4S2/c18-14-8-7-13(26-14)17-20(16(22)10-25-17)11-3-5-12(6-4-11)24-9-1-2-15(21)19-23/h3-8,17,23H,1-2,9-10H2,(H,19,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Federal de Pernambuco Curated by ChEMBL					Assay Description Inhibition of HDAC1 (unknown origin) using Ac-peptide as substrate pretreated for 15 mins followed by substrate addition and measured after 60 mins b...				Eur J Med Chem 170: 237-260 (2019) Article DOI: 10.1016/j.ejmech.2019.03.024
					More data for this Ligand-Target Pair