BDBM50173792 2-(2-aminophenyl)-1-hydroxyethane-1,1-diyldiphosphonic acid::CHEMBL414849::[2-(2-amino-phenyl)-1-hydroxy-1-phosphono-ethyl]-phosphonic acid::hydrogen [2-(2-azaniumylphenyl)-1-hydroxy-1-phosphonatoethyl]phosphonate

SMILES Nc1ccccc1CC(O)(P(O)(O)=O)P(O)(O)=O

InChI Key InChIKey=VJXYJONFUZXZJZ-UHFFFAOYSA-N

Data  2 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50173792   

TargetFarnesyl pyrophosphate synthase(Homo sapiens (Human))
University Of Oxford

Curated by ChEMBL
LigandPNGBDBM50173792(2-(2-aminophenyl)-1-hydroxyethane-1,1-diyldiphosph...)
Affinity DataKi:  3.40nMAssay Description:Inhibition of human recombinant FPPS expressed in Escherichia coli BL21 after 10 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetFarnesyl pyrophosphate synthase(Homo sapiens (Human))
University Of Oxford

Curated by ChEMBL
LigandPNGBDBM50173792(2-(2-aminophenyl)-1-hydroxyethane-1,1-diyldiphosph...)
Affinity DataKi:  64.6nMAssay Description:Inhibition of human recombinant FPPS expressed in Escherichia coli BL21More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetH(+)-exporting diphosphatase(Trypanosoma brucei)
University Of Illinois At Urbana-Champaign

Curated by ChEMBL
LigandPNGBDBM50173792(2-(2-aminophenyl)-1-hydroxyethane-1,1-diyldiphosph...)
Affinity DataIC50:  2.10E+3nMAssay Description:Inhibition of recombinant Trypanosoma brucei soluble vacuolar pyrophosphatase expressed in Escherichia coliMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetFarnesyl pyrophosphate synthase(Homo sapiens (Human))
University Of Oxford

Curated by ChEMBL
LigandPNGBDBM50173792(2-(2-aminophenyl)-1-hydroxyethane-1,1-diyldiphosph...)
Affinity DataIC50:  21.6nMAssay Description:Inhibition of human recombinant FPPS expressed in Escherichia coli BL21 after 10 minsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetFarnesyl pyrophosphate synthase(Homo sapiens (Human))
University Of Oxford

Curated by ChEMBL
LigandPNGBDBM50173792(2-(2-aminophenyl)-1-hydroxyethane-1,1-diyldiphosph...)
Affinity DataIC50:  371nMAssay Description:Inhibition of human recombinant FPPS expressed in Escherichia coli BL21More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed