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BDBM50225563 2-(methyl, licosylsulfonium-1-yl)ethylidene-1,1-bisphosphonic acid::CHEMBL237379

SMILES: CCCCCCCCCCCCCCCCCCCC[S+](C)CC(P(O)(O)=O)P(O)([O-])=O

InChI Key: InChIKey=GQOHXUYLYPUZRH-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50225563   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Farnesyl diphosphate synthase


(Homo sapiens (Human))
BDBM50225563
PNG
(2-(methyl, licosylsulfonium-1-yl)ethylidene-1,1-bi...)
Show SMILES CCCCCCCCCCCCCCCCCCCC[S+](C)CC(P(O)(O)=O)P(O)([O-])=O
Show InChI InChI=1S/C23H50O6P2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-32(2)22-23(30(24,25)26)31(27,28)29/h23H,3-22H2,1-2H3,(H3-,24,25,26,27,28,29)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 2.74E+4n/an/an/an/an/an/a



University of Illinois at Urbana-Champaign

Curated by ChEMBL


Assay Description
Inhibition of human FPPS


J Med Chem 50: 6067-79 (2007)


Article DOI: 10.1021/jm700991k
BindingDB Entry DOI: 10.7270/Q2CZ36VH
More data for this
Ligand-Target Pair