BDBM50132608 (1-Phosphono-hexyl)-phosphonic acid::CHEMBL280463

SMILES: CCCCCC(P(O)(O)=O)P(O)(O)=O

InChI Key: InChIKey=HOWTZHBAEIAYRZ-UHFFFAOYSA-N

Data: 2 KI  3 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50132608   

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
Farnesyl diphosphate synthase (Homo sapiens (Human))	BDBM50132608 ((1-Phosphono-hexyl)-phosphonic acid | CHEMBL280463) Show SMILES CCCCCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C6H16O6P2/c1-2-3-4-5-6(13(7,8)9)14(10,11)12/h6H,2-5H2,1H3,(H2,7,8,9)(H2,10,11,12)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	470	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Buenos Aires Curated by ChEMBL					Assay Description Binding affinity of the compound towards T. cruzi farnesyl pyrophosphate synthase (TcFPPS)				Bioorg Med Chem Lett 13: 3231-5 (2003) BindingDB Entry DOI: 10.7270/Q2ZK5G2R
					More data for this Ligand-Target Pair
Farnesyl diphosphate synthase (Homo sapiens (Human))	BDBM50132608 ((1-Phosphono-hexyl)-phosphonic acid | CHEMBL280463) Show SMILES CCCCCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C6H16O6P2/c1-2-3-4-5-6(13(7,8)9)14(10,11)12/h6H,2-5H2,1H3,(H2,7,8,9)(H2,10,11,12)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	920	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Binding affinity towards farnesyl Pyrophosphate Synthase using [14C]- isopentenyl pyrophosphate as radioligand				J Med Chem 46: 5171-83 (2003) Article DOI: 10.1021/jm0302344 BindingDB Entry DOI: 10.7270/Q24M93Z8
					More data for this Ligand-Target Pair
Farnesyl diphosphate synthase (Homo sapiens (Human))	BDBM50132608 ((1-Phosphono-hexyl)-phosphonic acid | CHEMBL280463) Show SMILES CCCCCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C6H16O6P2/c1-2-3-4-5-6(13(7,8)9)14(10,11)12/h6H,2-5H2,1H3,(H2,7,8,9)(H2,10,11,12)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Inhibitory activity against farnesyl Pyrophosphate Synthase expressed as #NAME? (M)				J Med Chem 46: 5171-83 (2003) Article DOI: 10.1021/jm0302344 BindingDB Entry DOI: 10.7270/Q24M93Z8
					More data for this Ligand-Target Pair
Farnesyl diphosphate synthase (Homo sapiens (Human))	BDBM50132608 ((1-Phosphono-hexyl)-phosphonic acid | CHEMBL280463) Show SMILES CCCCCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C6H16O6P2/c1-2-3-4-5-6(13(7,8)9)14(10,11)12/h6H,2-5H2,1H3,(H2,7,8,9)(H2,10,11,12)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	5.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Buenos Aires Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi farnesyl pyrophosphate synthase				Bioorg Med Chem Lett 13: 3231-5 (2003) BindingDB Entry DOI: 10.7270/Q2ZK5G2R
					More data for this Ligand-Target Pair
Farnesyl diphosphate synthase (Homo sapiens (Human))	BDBM50132608 ((1-Phosphono-hexyl)-phosphonic acid | CHEMBL280463) Show SMILES CCCCCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C6H16O6P2/c1-2-3-4-5-6(13(7,8)9)14(10,11)12/h6H,2-5H2,1H3,(H2,7,8,9)(H2,10,11,12)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	9.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Inhibitory activity against farnesyl Pyrophosphate Synthase was determined				J Med Chem 46: 5171-83 (2003) Article DOI: 10.1021/jm0302344 BindingDB Entry DOI: 10.7270/Q24M93Z8
					More data for this Ligand-Target Pair