BDBM50339183 2-[2-(4-Isobutylphenyl)propionoyloxy]ethanesulfonylhydroxamic Acid::CHEMBL1689433

SMILES: CC(C)Cc1ccc(cc1)C(C)C(=O)OCCS(=O)(=O)NO

InChI Key: InChIKey=NHAFPIODNRDSPX-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 = 50339183   

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
Cyclooxygenase (Homo sapiens (Human))	BDBM50339183 (2-[2-(4-Isobutylphenyl)propionoyloxy]ethanesulfony...) Show SMILES CC(C)Cc1ccc(cc1)C(C)C(=O)OCCS(=O)(=O)NO Show InChI InChI=1S/C15H23NO5S/c1-11(2)10-13-4-6-14(7-5-13)12(3)15(17)21-8-9-22(19,20)16-18/h4-7,11-12,16,18H,8-10H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Alberta Curated by ChEMBL					Assay Description Inhibition of human recombinant COX-2				J Med Chem 54: 1356-64 (2011) Article DOI: 10.1021/jm101403g BindingDB Entry DOI: 10.7270/Q2RJ4KFB
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase) (Ovis aries (Sheep))	BDBM50339183 (2-[2-(4-Isobutylphenyl)propionoyloxy]ethanesulfony...) Show SMILES CC(C)Cc1ccc(cc1)C(C)C(=O)OCCS(=O)(=O)NO Show InChI InChI=1S/C15H23NO5S/c1-11(2)10-13-4-6-14(7-5-13)12(3)15(17)21-8-9-22(19,20)16-18/h4-7,11-12,16,18H,8-10H2,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Alberta Curated by ChEMBL					Assay Description Inhibition of ovine COX-1				J Med Chem 54: 1356-64 (2011) Article DOI: 10.1021/jm101403g BindingDB Entry DOI: 10.7270/Q2RJ4KFB
					More data for this Ligand-Target Pair