BDBM50527302 CHEMBL4573736::US10829446, Compound 146

SMILES: CC(=C)COc1cc(C)c(F)c(c1)C(=O)NNS(=O)(=O)c1ccccc1

InChI Key: InChIKey=LHSWJCXJQGILOC-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 = 50527302   

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 KAT6A (Homo sapiens)	BDBM50527302 (CHEMBL4573736 | US10829446, Compound 146) Show SMILES CC(=C)COc1cc(C)c(F)c(c1)C(=O)NNS(=O)(=O)c1ccccc1 Show InChI InChI=1S/C18H19FN2O4S/c1-12(2)11-25-14-9-13(3)17(19)16(10-14)18(22)20-21-26(23,24)15-7-5-4-6-8-15/h4-10,21H,1,11H2,2-3H3,(H,20,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
MONASH UNIVERSITY; The Walter and Eliza Hall Institute of Medical Research US Patent					Assay Description Active Moz protein was expressed as N-terminal fusion protein with a His6 tag in BL21 E. coli cells. Protein purification was performed via nickel-im...				US Patent US10829446 (2020)
					More data for this Ligand-Target Pair
Histone acetyltransferase KAT6A (Homo sapiens)	BDBM50527302 (CHEMBL4573736 | US10829446, Compound 146) Show SMILES CC(=C)COc1cc(C)c(F)c(c1)C(=O)NNS(=O)(=O)c1ccccc1 Show InChI InChI=1S/C18H19FN2O4S/c1-12(2)11-25-14-9-13(3)17(19)16(10-14)18(22)20-21-26(23,24)15-7-5-4-6-8-15/h4-10,21H,1,11H2,2-3H3,(H,20,22)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Monash University (Parkville Campus) Curated by ChEMBL					Assay Description Inhibition of N-terminal NusA-fused His6-tagged human KAT6A (507 to 778 residues) expressed in Escherichia coli BL21 (DE3) cells using 0.4 uM acetyl ...				J Med Chem 63: 4655-4684 (2020) Article DOI: 10.1021/acs.jmedchem.9b02071
					More data for this Ligand-Target Pair