Reaction Details Report a problem with these data
Target
Geranylgeranyl pyrophosphate synthase
Ligand
BDBM50031853
Substrate
n/a
Meas. Tech.
ChEMBL_474597 (CHEMBL922066)
IC50
100±n/a nM
Citation
 Wiemer, AJ; Yu, JS; Lamb, KM; Hohl, RJ; Wiemer, DF Mono- and dialkyl isoprenoid bisphosphonates as geranylgeranyl diphosphate synthase inhibitors. Bioorg Med Chem 16:390-9 (2008) [PubMed]  Article 
Target
Name:
Geranylgeranyl pyrophosphate synthase
Synonyms:
Dimethylallyltranstransferase | Farnesyltranstransferase | GGPP synthetase | GGPPS_HUMAN | GGPPSase | GGPS1 | Geranylgeranyl Diphosphate Synthase (GGPPS) | Geranylgeranyl diphosphate synthase | Geranylgeranyl pyrophosphate synthetase | Geranyltranstransferase
Type:
Homooctamer; transferase
Mol. Mass.:
34867.94
Organism:
Homo sapiens (Human)
Description:
Recombinant human GGPPS was cloned and expressed in E. coli.
Residue:
300
Sequence:
MEKTQETVQRILLEPYKYLLQLPGKQVRTKLSQAFNHWLKVPEDKLQIIIEVTEMLHNASLLIDDIEDNSKLRRGFPVAHSIYGIPSVINSANYVYFLGLEKVLTLDHPDAVKLFTRQLLELHQGQGLDIYWRDNYTCPTEEEYKAMVLQKTGGLFGLAVGLMQLFSDYKEDLKPLLNTLGLFFQIRDDYANLHSKEYSENKSFCEDLTEGKFSFPTIHAIWSRPESTQVQNILRQRTENIDIKKYCVHYLEDVGSFEYTRNTLKELEAKAYKQIDARGGNPELVALVKHLSKMFKEENE
  
Inhibitor
Name:
BDBM50031853
Synonyms:
((3E,7E)-4,8,12-Trimethyl-1-phosphono-trideca-3,7,11-trienyl)-phosphonic acid | (2E,6E)-farnesylbisphosphonate | 2E,6E-farnesyl bisphosphonate | CHEMBL86513
Type:
Small organic molecule
Emp. Form.:
C16H30O6P2
Mol. Mass.:
380.3533
SMILES:
[#6]-[#6](-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]\[#6]=[#6](/P([#8])([#8])=O)P([#8])([#8])=O
Structure:
Search PDB for entries with ligand similarity: