BDBM50281603 [Hydroxy-((2E,6E)-3,7,11-trimethyl-dodeca-2,6,10-trienyloxymethyl)-phosphinoylmethyl]-phosphonic acid

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

InChI Key: InChIKey=NQSFGDNIHNVCHW-KKYJLSSQSA-K

Data: 1 KI

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 = 50281603   

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 synthetase (Rattus norvegicus)	BDBM50281603 ([Hydroxy-((2E,6E)-3,7,11-trimethyl-dodeca-2,6,10-t...) Show SMILES [#6]\[#6](-[#6])=[#6]/[#6]-[#6]\[#6](-[#6])=[#6]/[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-[#6]P([#8-])(=O)[#6]P([#8-])([#8-])=O Show InChI InChI=1S/C17H32O6P2/c1-15(2)7-5-8-16(3)9-6-10-17(4)11-12-23-13-24(18,19)14-25(20,21)22/h7,9,11H,5-6,8,10,12-14H2,1-4H3,(H,18,19)(H2,20,21,22)/p-3/b16-9-,17-11+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article	37	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Tested for inhibitory potency against rat liver microsomal squalene synthase				Bioorg Med Chem Lett 3: 595-600 (1993) Article DOI: 10.1016/S0960-894X(01)81236-1 BindingDB Entry DOI: 10.7270/Q25Q4WMR
					More data for this Ligand-Target Pair