Reaction Details Report a problem with these data
Target
Farnesyl diphosphate synthase
Ligand
BDBM50341918
Substrate
n/a
Meas. Tech.
ChEMBL_1885447 (CHEMBL4387029)
IC50
58±n/a nM
Citation
 Galaka, T; Falcone, BN; Li, C; Szajnman, SH; Moreno, SNJ; Docampo, R; Rodriguez, JB Synthesis and biological evaluation of 1-alkylaminomethyl-1,1-bisphosphonic acids against Trypanosoma cruzi and Toxoplasma gondii. Bioorg Med Chem 27:3663-3673 (2019) [PubMed]  Article 
Target
Name:
Farnesyl diphosphate synthase
Synonyms:
n/a
Type:
PROTEIN
Mol. Mass.:
48827.21
Organism:
Trypanosoma cruzi
Description:
ChEMBL_939177
Residue:
425
Sequence:
MTAFACFPHSLFYSTRLPFFFFFFCVCVHCCLRYLCLLKCAYCCSDKNYFRPLNYFFYCLYLAMASMERFLSVYDEVQAFLLDQLQSKYEIDPNRARYLRIMMDTTCLGGKYFRGMTVVNVAEGFLAVTQHDEATKERILHDACVGGWMIEFLQAHYLVEDDIMDGSVMRRGKPCWYRFPGVTTQCAINDGIILKSWTQIMAWHYFADRPFLKDLLCLFQKVDYATAVGQMYDVTSMCDSNKLDPEVAQPMTTDFAEFTPAIYKRIVKYKTTFYTYLLPLVMGLLVSEAAASVEMNLVERVAHLIGEYFQVQDDVMDCFTPPEQLGKVGTDIEDAKCSWLAVTFLGKANAAQVAEFKANYGEKDPAKVAVVKRLYSKANLQADFAAYEAEVVREVESLIEQLKVKSPTFAESVAVVWEKTHKRKK
  
Inhibitor
Name:
BDBM50341918
Synonyms:
(2-heptylamino-1-phosphono-ethyl)-phosphonic acid | 1-[(n-hept-1-ylamino)ethyl]-1,1-bisphosphonic acid | 2-(heptylamino)ethane-1,1-diyldiphosphonic acid | CHEMBL261473
Type:
Small organic molecule
Emp. Form.:
C9H23NO6P2
Mol. Mass.:
303.2295
SMILES:
CCCCCCCNCC(P(O)(O)=O)P(O)(O)=O
Structure:
Search PDB for entries with ligand similarity: