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BDBM25256 bisphosphonate, 9::hydrogen [2-(dodecyldimethylphosphanylium)-1-phosphonoethyl]phosphonate

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

InChI Key: InChIKey=QCMHKGWUOSRYCF-UHFFFAOYSA-N

Data: 1 IC50

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 25256   
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
Geranylgeranyl Diphosphate Synthase (GGPPS)


(Homo sapiens (Human))
BDBM25256
PNG
(bisphosphonate, 9 | hydrogen [2-(dodecyldimethylph...)
Show SMILES CCCCCCCCCCCC[P+](C)(C)CC(P(O)(O)=O)P(O)([O-])=O
Show InChI InChI=1S/C16H37O6P3/c1-4-5-6-7-8-9-10-11-12-13-14-23(2,3)15-16(24(17,18)19)25(20,21)22/h16H,4-15H2,1-3H3,(H3-,17,18,19,20,21,22)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 100n/an/an/an/a7.037



National Taiwan University



Assay Description
The inhibitory activity of each test compound was evaluated by monitoring the formation of [14C]GGPP from FPP, using [14C]IPP as the substrate. To co...


J Med Chem 51: 5594-607 (2008)


Article DOI: 10.1021/jm800325y
BindingDB Entry DOI: 10.7270/Q2028PVT
More data for this
Ligand-Target Pair