BDBM50247840 CHEMBL489116::Methyl 4-(5-chloro-3-oxoisothiazol-2(3H)-yl)butanoate

SMILES: COC(=O)CCCn1sc(Cl)cc1=O

InChI Key: InChIKey=MHGPTTDXFIMHMY-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 = 50247840   

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))	BDBM50247840 (CHEMBL489116 | Methyl 4-(5-chloro-3-oxoisothiazol-...) Show SMILES COC(=O)CCCn1sc(Cl)cc1=O Show InChI InChI=1S/C8H10ClNO3S/c1-13-8(12)3-2-4-10-7(11)5-6(9)14-10/h5H,2-4H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Groningen Curated by ChEMBL					Assay Description Inhibition of human recombinant HAT PCAF				Bioorg Med Chem 17: 460-6 (2009) Article DOI: 10.1016/j.bmc.2008.12.008 BindingDB Entry DOI: 10.7270/Q2BC3ZDM
					More data for this Ligand-Target Pair