BDBM25291 bisphosphonate, 40::{2-[5-(decyloxy)pyridin-3-yl]-1-phosphonoethyl}phosphonic acid
SMILES: CCCCCCCCCCOc1cncc(CC(P(O)(O)=O)P(O)(O)=O)c1
InChI Key: InChIKey=CXNUSEYMNGPVLV-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
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Geranylgeranyl Diphosphate Synthase (GGPPS) (Homo sapiens (Human)) | BDBM25291 (bisphosphonate, 40 | {2-[5-(decyloxy)pyridin-3-yl]...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 4.57E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
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 |