BDBM50281970 (9E,13E,21E)-5,9,14,18,22-Pentamethyl-1-nitro-tricosa-5,9,13,17,21-pentaen-1-ol::CHEMBL27988

SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]-[#6]-[#6](-[#8])-[#6]-[#7+](-[#8-])=O

InChI Key: InChIKey=URVNPCFXXZJZGQ-LVZDJRPSSA-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 = 50281970   

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 (Homo sapiens (Human))	BDBM50281970 ((9E,13E,21E)-5,9,14,18,22-Pentamethyl-1-nitro-tric...) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]-[#6]-[#6](-[#8])-[#6]-[#7+](-[#8-])=O Show InChI InChI=1S/C29H49NO3/c1-24(2)13-9-16-27(5)19-10-17-25(3)14-7-8-15-26(4)18-11-20-28(6)21-12-22-29(31)23-30(32)33/h13-15,19-20,29,31H,7-12,16-18,21-23H2,1-6H3/b25-14+,26-15+,27-19+,28-20+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article	n/a	n/a	2.70E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibitory concentration of the compound at which 50% decrease in the activity of Squalene epoxidase in pig liver microsomes				Bioorg Med Chem Lett 3: 1319-1322 (1993) Article DOI: 10.1016/S0960-894X(00)80339-X BindingDB Entry DOI: 10.7270/Q25X28W6
					More data for this Ligand-Target Pair