BDBM50300424 CHEMBL572965::Methyl 3-(5-chloro-4-methyl-3-oxoisothiazol-2(3H)-yl)propanoate

SMILES: COC(=O)CCn1sc(Cl)c(C)c1=O

InChI Key: InChIKey=YETKKDGVXTZNOU-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 = 50300424   

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 acetyltransferase PCAF (Homo sapiens (Human))	BDBM50300424 (CHEMBL572965 | Methyl 3-(5-chloro-4-methyl-3-oxois...) Show SMILES COC(=O)CCn1sc(Cl)c(C)c1=O Show InChI InChI=1S/C8H10ClNO3S/c1-5-7(9)14-10(8(5)12)4-3-6(11)13-2/h3-4H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Groningen Curated by ChEMBL					Assay Description Inhibition of human recombinant histone acetyltransferase PCAF assessed as CoA-SH activity preincubated for 15 mins by CPM fluorescent assay				Eur J Med Chem 44: 4855-61 (2009) Article DOI: 10.1016/j.ejmech.2009.07.025 BindingDB Entry DOI: 10.7270/Q2XD11RS
					More data for this Ligand-Target Pair