null
SMILES NCCC(O)(P(O)(O)=O)P(O)(O)=O
InChI Key InChIKey=WRUUGTRCQOWXEG-UHFFFAOYSA-N
PDB links: 9 PDB IDs match this monomer. 1 PDB ID contains this monomer as substructures. 3 PDB IDs contain inhibitors having a similarity of 90% to this monomer.
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 5 hits for monomerid = 12581
Affinity DataKi: 55.9nMAssay Description:Inhibition of human recombinant FPPS expressed in Escherichia coli BL21 after 10 minsMore data for this Ligand-Target Pair
In DepthDetails
Article
BindingDB Entry DOI: 10.7270/Q2W95B18PubMedDrugBank
MMDB
PDB
3D Structure (crystal)
BindingDB Entry DOI: 10.7270/Q2W95B18PubMedDrugBank
MMDB
PDB
3D Structure (crystal)
Affinity DataKi: 180nMAssay Description:Binding affinity towards farnesyl Pyrophosphate Synthase using [14C]- isopentenyl pyrophosphate as radioligandMore data for this Ligand-Target Pair
In DepthDetails
Article
BindingDB Entry DOI: 10.7270/Q24M93Z8PubMedDrugBank
MMDB
PDB
3D Structure (crystal)
BindingDB Entry DOI: 10.7270/Q24M93Z8PubMedDrugBank
MMDB
PDB
3D Structure (crystal)
TargetPolyprenyl synthetase family protein(Plasmodium falciparum (isolate 3D7))
University of Illinois at Urbana-Champaign
Curated by ChEMBL
University of Illinois at Urbana-Champaign
Curated by ChEMBL
Affinity DataKi: 190nMAssay Description:Binding affinity towards Farnesyl diphosphate synthase from leishmania majorMore data for this Ligand-Target Pair
Affinity DataKi: 331nMAssay Description:Inhibition of human recombinant FPPS expressed in Escherichia coli BL21More data for this Ligand-Target Pair
In DepthDetails
Article
BindingDB Entry DOI: 10.7270/Q2W95B18PubMedDrugBank
MMDB
PDB
3D Structure (crystal)
BindingDB Entry DOI: 10.7270/Q2W95B18PubMedDrugBank
MMDB
PDB
3D Structure (crystal)
TargetHypoxanthine-guanine phosphoribosyltransferase(Trypanosoma brucei brucei)
Universidad de Buenos Aires
Curated by ChEMBL
Universidad de Buenos Aires
Curated by ChEMBL
Affinity DataKi: 5.06E+4nMAssay Description:Inhibition of hypoxanthine-guanine phosphoribosyltransferase (TcHPRT)More data for this Ligand-Target Pair
Activity Spreadsheet -- ITC Data from BindingDB
Found 1 hit for monomerid = 12581
CellFarnesyl Diphosphate Synthase (FPPS)(Trypanosoma brucei)
University of Illinois at Urbana-Champaign
University of Illinois at Urbana-Champaign
ITC DataΔG°: -8.84kcal/mole −TΔS°: -9.35kcal/mole ΔH°: 0.479kcal/mole logk: 3.12E+6
pH: 7.4 T: 26.85°C
pH: 7.4 T: 26.85°C