BDBM50422458 CHEMBL100835

SMILES: CN(CCCOc1cccc(C)c1)CCC(O)(P(O)(O)=O)P(O)(O)=O

InChI Key: InChIKey=VKCKEACFQGUUMQ-UHFFFAOYSA-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 = 50422458   

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
Farnesyl diphosphate synthase (Homo sapiens (Human))	BDBM50422458 (CHEMBL100835) Show SMILES CN(CCCOc1cccc(C)c1)CCC(O)(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C14H25NO8P2/c1-12-5-3-6-13(11-12)23-10-4-8-15(2)9-7-14(16,24(17,18)19)25(20,21)22/h3,5-6,11,16H,4,7-10H2,1-2H3,(H2,17,18,19)(H2,20,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.30	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Negative logarithm of inhibitory concentration against bone resorption				J Med Chem 46: 2932-44 (2003) Article DOI: 10.1021/jm030054u BindingDB Entry DOI: 10.7270/Q2R78GHD
					More data for this Ligand-Target Pair