Compile Data Set for Download or QSAR

Found 6 hits of ic50 for monomerid = 50341914   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Farnesyl diphosphate synthase (Toxoplasma gondii)	BDBM50341914 (1-[(n-Dodec-1-ylamino)ethyl]1,1-bisphosphonic acid...) Show SMILES CCCCCCCCCCCCNCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C14H33NO6P2/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-14(22(16,17)18)23(19,20)21/h14-15H,2-13H2,1H3,(H2,16,17,18)(H2,19,20,21)	UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	93	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Buenos Aires Curated by ChEMBL					Assay Description Inhibition of Toxoplasma gondii FPPS after 30 mins using [14C]IPP by scintillation counting				Bioorg Med Chem 19: 2211-7 (2011) Article DOI: 10.1016/j.bmc.2011.02.037 BindingDB Entry DOI: 10.7270/Q2R211QB
					More data for this Ligand-Target Pair
Farnesyl diphosphate synthase (Toxoplasma gondii)	BDBM50341914 (1-[(n-Dodec-1-ylamino)ethyl]1,1-bisphosphonic acid...) Show SMILES CCCCCCCCCCCCNCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C14H33NO6P2/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-14(22(16,17)18)23(19,20)21/h14-15H,2-13H2,1H3,(H2,16,17,18)(H2,19,20,21)	UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	93	n/a	n/a	n/a	n/a	n/a	n/a
Universidad de Buenos Aires Curated by ChEMBL					Assay Description Inhibition of Toxoplasma gondii FPPS using DMAPP as substrate incubated for 30 mins measured by scintillation counting				Bioorg Med Chem 27: 3663-3673 (2019) Article DOI: 10.1016/j.bmc.2019.07.004 BindingDB Entry DOI: 10.7270/Q2W380RM
					More data for this Ligand-Target Pair
Farnesyl diphosphate synthase (Trypanosoma cruzi)	BDBM50341914 (1-[(n-Dodec-1-ylamino)ethyl]1,1-bisphosphonic acid...) Show SMILES CCCCCCCCCCCCNCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C14H33NO6P2/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-14(22(16,17)18)23(19,20)21/h14-15H,2-13H2,1H3,(H2,16,17,18)(H2,19,20,21)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	810	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 FPPS using DMAPP as substrate incubated for 30 mins measured by scintillation counting				Bioorg Med Chem 27: 3663-3673 (2019) Article DOI: 10.1016/j.bmc.2019.07.004 BindingDB Entry DOI: 10.7270/Q2W380RM
					More data for this Ligand-Target Pair
Farnesyl diphosphate synthase (Trypanosoma cruzi)	BDBM50341914 (1-[(n-Dodec-1-ylamino)ethyl]1,1-bisphosphonic acid...) Show SMILES CCCCCCCCCCCCNCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C14H33NO6P2/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-14(22(16,17)18)23(19,20)21/h14-15H,2-13H2,1H3,(H2,16,17,18)(H2,19,20,21)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	811	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 FPPS after 30 mins using [14C]IPP by scintillation counting				Bioorg Med Chem 19: 2211-7 (2011) Article DOI: 10.1016/j.bmc.2011.02.037 BindingDB Entry DOI: 10.7270/Q2R211QB
					More data for this Ligand-Target Pair
Solanesyl diphosphate synthase (Trypanosoma cruzi)	BDBM50341914 (1-[(n-Dodec-1-ylamino)ethyl]1,1-bisphosphonic acid...) Show SMILES CCCCCCCCCCCCNCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C14H33NO6P2/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-14(22(16,17)18)23(19,20)21/h14-15H,2-13H2,1H3,(H2,16,17,18)(H2,19,20,21)	UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.18E+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 SPPS after 30 mins using [14C]IPP by scintillation counting				Bioorg Med Chem 19: 2211-7 (2011) Article DOI: 10.1016/j.bmc.2011.02.037 BindingDB Entry DOI: 10.7270/Q2R211QB
					More data for this Ligand-Target Pair
Decaprenyl diphosphate synthase (Mycobacterium tuberculosis H37Rv)	BDBM50341914 (1-[(n-Dodec-1-ylamino)ethyl]1,1-bisphosphonic acid...) Show SMILES CCCCCCCCCCCCNCC(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C14H33NO6P2/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-14(22(16,17)18)23(19,20)21/h14-15H,2-13H2,1H3,(H2,16,17,18)(H2,19,20,21)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.70E+5	n/a	n/a	n/a	n/a	7.5	n/a
University of California San Diego					Assay Description We screened an in-house library of 53 compounds using trans-FPP as substrate. Briefly, the condensation of IPP and GPP, FPP, or cis-FPP catalyzed by ...				Chem Biol Drug Des 85: 756-69 (2015) Article DOI: 10.1111/cbdd.12463 BindingDB Entry DOI: 10.7270/Q2ZG6QZN
					More data for this Ligand-Target Pair