BDBM50093887 3,4,5-Trihydroxy-benzoic acid dodecyl ester::CHEMBL16121::Dodecyl 3,4,5-trihydroxybenzoate::dodecyl gallate::n-dodecylgallate

SMILES: CCCCCCCCCCCCOC(=O)c1cc(O)c(O)c(O)c1

InChI Key: InChIKey=RPWFJAMTCNSJKK-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 = 50093887   

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
Squalene monooxygenase (Rattus norvegicus)	BDBM50093887 (3,4,5-Trihydroxy-benzoic acid dodecyl ester | CHEM...) Show SMILES CCCCCCCCCCCCOC(=O)c1cc(O)c(O)c(O)c1 Show InChI InChI=1S/C19H30O5/c1-2-3-4-5-6-7-8-9-10-11-12-24-19(23)15-13-16(20)18(22)17(21)14-15/h13-14,20-22H,2-12H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
University of Shizuoka Curated by ChEMBL					Assay Description Inhibition of C-terminal hexahistidine-tagged rat recombinant squalene epoxidase without N-terminal putative membrane domain expressed in Escherichia...				J Nat Prod 64: 1010-4 (2001) BindingDB Entry DOI: 10.7270/Q25Q4X03
					More data for this Ligand-Target Pair
Squalene monooxygenase (Rattus norvegicus)	BDBM50093887 (3,4,5-Trihydroxy-benzoic acid dodecyl ester | CHEM...) Show SMILES CCCCCCCCCCCCOC(=O)c1cc(O)c(O)c(O)c1 Show InChI InChI=1S/C19H30O5/c1-2-3-4-5-6-7-8-9-10-11-12-24-19(23)15-13-16(20)18(22)17(21)14-15/h13-14,20-22H,2-12H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
University of Shizuoka Curated by ChEMBL					Assay Description Compound was evaluated for its inhibitory activity against recombinant rat SE(squalene epoxidase)				Bioorg Med Chem Lett 10: 2525-8 (2001) BindingDB Entry DOI: 10.7270/Q2M9096Q
					More data for this Ligand-Target Pair