Compile Data Set for Download or QSAR

Found 28 hits with Last Name = 'widmer' and Initial = 'f'   

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
Phospholipase B (Cryptococcus neoformans)	BDBM50180984 (1,12-Bis(tripentyl ammonium)dodecane dibromide | C...) Show SMILES CCCCC[N+](CCCCC)(CCCCC)CCCCCCCCCCCC[N+](CCCCC)(CCCCC)CCCCC Show InChI InChI=1S/C42H90N2/c1-7-13-27-35-43(36-28-14-8-2,37-29-15-9-3)41-33-25-23-21-19-20-22-24-26-34-42-44(38-30-16-10-4,39-31-17-11-5)40-32-18-12-6/h7-42H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50180993 (1,12-Bis(tripropyl ammonium)dodecane dibromide | C...) Show SMILES CCC[N+](CCC)(CCC)CCCCCCCCCCCC[N+](CCC)(CCC)CCC Show InChI InChI=1S/C30H66N2/c1-7-23-31(24-8-2,25-9-3)29-21-19-17-15-13-14-16-18-20-22-30-32(26-10-4,27-11-5)28-12-6/h7-30H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50180985 (1,12-Bis(trihexyl ammonium)dodecane dichloride | C...) Show SMILES CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCCCCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC Show InChI InChI=1S/C48H102N2/c1-7-13-19-33-41-49(42-34-20-14-8-2,43-35-21-15-9-3)47-39-31-29-27-25-26-28-30-32-40-48-50(44-36-22-16-10-4,45-37-23-17-11-5)46-38-24-18-12-6/h7-48H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50180987 (1,12-Bis(triisopentyl ammonium)dodecane dichloride...) Show SMILES CC(C)CC[N+](CCCCCCCCCCCC[N+](CCC(C)C)(CCC(C)C)CCC(C)C)(CCC(C)C)CCC(C)C Show InChI InChI=1S/C42H90N2/c1-37(2)23-31-43(32-24-38(3)4,33-25-39(5)6)29-21-19-17-15-13-14-16-18-20-22-30-44(34-26-40(7)8,35-27-41(9)10)36-28-42(11)12/h37-42H,13-36H2,1-12H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50180986 (1,12-Bis(tributyl ammonium)dodecane dichloride | C...) Show SMILES CCCC[N+](CCCC)(CCCC)CCCCCCCCCCCC[N+](CCCC)(CCCC)CCCC Show InChI InChI=1S/C36H78N2/c1-7-13-29-37(30-14-8-2,31-15-9-3)35-27-25-23-21-19-20-22-24-26-28-36-38(32-16-10-4,33-17-11-5)34-18-12-6/h7-36H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50180992 (1,12-Bis(tributyl phosphonium)dodecane dibromide |...) Show SMILES CCCC[P+](CCCC)(CCCC)CCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC Show InChI InChI=1S/C36H78P2/c1-7-13-29-37(30-14-8-2,31-15-9-3)35-27-25-23-21-19-20-22-24-26-28-36-38(32-16-10-4,33-17-11-5)34-18-12-6/h7-36H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304136 (1,12-Bis(3',4'-dipentylpyridinium)dodecane dichlor...) Show SMILES CCCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCCC)c(CCCCC)c2)cc1CCCCC Show InChI InChI=1S/C42H74N2/c1-5-9-21-27-39-31-35-43(37-41(39)29-23-11-7-3)33-25-19-17-15-13-14-16-18-20-26-34-44-36-32-40(28-22-10-6-2)42(38-44)30-24-12-8-4/h31-32,35-38H,5-30,33-34H2,1-4H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304137 (1,12-Bis(4'-(5''-nonylpyridinium)dodecane dichlori...) Show SMILES CCCCC(CCCC)c1cc[n+](CCCCCCCCCCCC[n+]2ccc(cc2)C(CCCC)CCCC)cc1 Show InChI InChI=1S/C40H70N2/c1-5-9-23-37(24-10-6-2)39-27-33-41(34-28-39)31-21-19-17-15-13-14-16-18-20-22-32-42-35-29-40(30-36-42)38(25-11-7-3)26-12-8-4/h27-30,33-38H,5-26,31-32H2,1-4H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304129 (1,12-Bis[4'-(1''-pentenyl)pyridinium]dodecanedichl...) Show SMILES C=CCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCC=C)cc2)cc1 Show InChI InChI=1S/C32H50N2/c1-3-5-15-19-31-21-27-33(28-22-31)25-17-13-11-9-7-8-10-12-14-18-26-34-29-23-32(24-30-34)20-16-6-4-2/h3-4,21-24,27-30H,1-2,5-20,25-26H2/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304130 (1,12-Bis(4'-isopentylpyridinium)dodecane dichlorid...) Show SMILES CC(C)CCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCC(C)C)cc2)cc1 Show InChI InChI=1S/C32H54N2/c1-29(2)15-17-31-19-25-33(26-20-31)23-13-11-9-7-5-6-8-10-12-14-24-34-27-21-32(22-28-34)18-16-30(3)4/h19-22,25-30H,5-18,23-24H2,1-4H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304133 (1,12-Bis[4'-(3' '-phenylpropyl)pyridinium]dodecane...) Show SMILES C(CCCCCC[n+]1ccc(CCCc2ccccc2)cc1)CCCCC[n+]1ccc(CCCc2ccccc2)cc1 Show InChI InChI=1S/C40H54N2/c1(3-5-7-15-31-41-33-27-39(28-34-41)25-17-23-37-19-11-9-12-20-37)2-4-6-8-16-32-42-35-29-40(30-36-42)26-18-24-38-21-13-10-14-22-38/h9-14,19-22,27-30,33-36H,1-8,15-18,23-26,31-32H2/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.04E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304135 (1,12-Bis(3'-methyl-4'-pentylpyridinium)dodecane di...) Show SMILES CCCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCCC)c(C)c2)cc1C Show InChI InChI=1S/C34H58N2/c1-5-7-17-21-33-23-27-35(29-31(33)3)25-19-15-13-11-9-10-12-14-16-20-26-36-28-24-34(32(4)30-36)22-18-8-6-2/h23-24,27-30H,5-22,25-26H2,1-4H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.34E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50060582 (1,10-Bis(trimethyl ammonium)decane dibromide | 1,1...) Show SMILES C[N+](C)(C)CCCCCCCCCC[N+](C)(C)C Show InChI InChI=1S/C16H38N2/c1-17(2,3)15-13-11-9-7-8-10-12-14-16-18(4,5)6/h7-16H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50060533 (1,12-Bis(trimethyl ammonium)dodecane dibromide | 1...) Show SMILES C[N+](C)(C)CCCCCCCCCCCC[N+](C)(C)C Show InChI InChI=1S/C18H42N2/c1-19(2,3)17-15-13-11-9-7-8-10-12-14-16-18-20(4,5)6/h7-18H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50119793 (1,1'-(dodecane-1,12-diyl)dipyridinium bromide | 1,...) Show SMILES C(CCCCCC[n+]1ccccc1)CCCCC[n+]1ccccc1 Show InChI InChI=1S/C22H34N2/c1(3-5-7-11-17-23-19-13-9-14-20-23)2-4-6-8-12-18-24-21-15-10-16-22-24/h9-10,13-16,19-22H,1-8,11-12,17-18H2/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304125 (1,1'-(dodecane-1,12-diyl)bis(4-methylpyridinium)br...) Show SMILES Cc1cc[n+](CCCCCCCCCCCC[n+]2ccc(C)cc2)cc1 Show InChI InChI=1S/C24H38N2/c1-23-13-19-25(20-14-23)17-11-9-7-5-3-4-6-8-10-12-18-26-21-15-24(2)16-22-26/h13-16,19-22H,3-12,17-18H2,1-2H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304126 (1,12-Bis(4'-ethylpyridinium)dodecane dibromide | C...) Show SMILES CCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CC)cc2)cc1 Show InChI InChI=1S/C26H42N2/c1-3-25-15-21-27(22-16-25)19-13-11-9-7-5-6-8-10-12-14-20-28-23-17-26(4-2)18-24-28/h15-18,21-24H,3-14,19-20H2,1-2H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304127 (1,12-Bis-(4-tert-butylpyridinium)dodecane dibromid...) Show SMILES CC(C)(C)c1cc[n+](CCCCCCCCCCCC[n+]2ccc(cc2)C(C)(C)C)cc1 Show InChI InChI=1S/C30H50N2/c1-29(2,3)27-17-23-31(24-18-27)21-15-13-11-9-7-8-10-12-14-16-22-32-25-19-28(20-26-32)30(4,5)6/h17-20,23-26H,7-16,21-22H2,1-6H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304128 (1,12-Bis(4'-pentylpyridinium)dodecane dichloride |...) Show SMILES CCCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCCC)cc2)cc1 Show InChI InChI=1S/C32H54N2/c1-3-5-15-19-31-21-27-33(28-22-31)25-17-13-11-9-7-8-10-12-14-18-26-34-29-23-32(24-30-34)20-16-6-4-2/h21-24,27-30H,3-20,25-26H2,1-2H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304131 (1,12-Bis(4'-hexylpyridinium)dodecane dichloride | ...) Show SMILES CCCCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCCCC)cc2)cc1 Show InChI InChI=1S/C34H58N2/c1-3-5-7-17-21-33-23-29-35(30-24-33)27-19-15-13-11-9-10-12-14-16-20-28-36-31-25-34(26-32-36)22-18-8-6-4-2/h23-26,29-32H,3-22,27-28H2,1-2H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304132 (1,12-Bis(4'-isohexylpyridinium)dodecane dichloride...) Show SMILES CC(C)CCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCC(C)C)cc2)cc1 Show InChI InChI=1S/C34H58N2/c1-31(2)17-15-19-33-21-27-35(28-22-33)25-13-11-9-7-5-6-8-10-12-14-26-36-29-23-34(24-30-36)20-16-18-32(3)4/h21-24,27-32H,5-20,25-26H2,1-4H3/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase A2, major isoenzyme (Sus scrofa (pig))	BDBM50304134 (1,12-Bis(4'-pyridinium propanol)dodecane dichlorid...) Show SMILES OCCCc1cc[n+](CCCCCCCCCCCC[n+]2ccc(CCCO)cc2)cc1 Show InChI InChI=1S/C28H46N2O2/c31-25-11-13-27-15-21-29(22-16-27)19-9-7-5-3-1-2-4-6-8-10-20-30-23-17-28(18-24-30)14-12-26-32/h15-18,21-24,31-32H,1-14,19-20,25-26H2/q+2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic PLA2 after 1 hr by radiometric method				Bioorg Med Chem 17: 6329-39 (2009) Article DOI: 10.1016/j.bmc.2009.07.037 BindingDB Entry DOI: 10.7270/Q27081JD
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50180988 (1,12-Bis(N-quinuclidlinium)dodecane dibromide | CH...) Show SMILES C(CCCCCC[N+]12CCC(CC1)CC2)CCCCC[N+]12CCC(CC1)CC2 Show InChI InChI=1S/C26H50N2/c1(3-5-7-9-17-27-19-11-25(12-20-27)13-21-27)2-4-6-8-10-18-28-22-14-26(15-23-28)16-24-28/h25-26H,1-24H2/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50084929 (1,12-Bis(triethyl ammonium)dodecane dibromide | CH...) Show SMILES CC[N+](CC)(CC)CCCCCCCCCCCC[N+](CC)(CC)CC Show InChI InChI=1S/C24H54N2/c1-7-25(8-2,9-3)23-21-19-17-15-13-14-16-18-20-22-24-26(10-4,11-5)12-6/h7-24H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50084949 (1,12-Bis(N-methylpyrrolidinium)dodecane dibromide ...) Show SMILES C[N+]1(CCCCCCCCCCCC[N+]2(C)CCCC2)CCCC1 Show InChI InChI=1S/C22H46N2/c1-23(19-13-14-20-23)17-11-9-7-5-3-4-6-8-10-12-18-24(2)21-15-16-22-24/h3-22H2,1-2H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50180989 (1,12-Bis(trioctyl ammonium)dodecane dichloride | C...) Show SMILES CCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCCCCCC[N+](CCCCCCCC)(CCCCCCCC)CCCCCCCC Show InChI InChI=1S/C60H126N2/c1-7-13-19-25-37-45-53-61(54-46-38-26-20-14-8-2,55-47-39-27-21-15-9-3)59-51-43-35-33-31-32-34-36-44-52-60-62(56-48-40-28-22-16-10-4,57-49-41-29-23-17-11-5)58-50-42-30-24-18-12-6/h7-60H2,1-6H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50180990 (1,12-Bis(N-methylmorpholinium)dodecane dibromide |...) Show SMILES C[N+]1(CCCCCCCCCCCC[N+]2(C)CCOCC2)CCOCC1 Show InChI InChI=1S/C22H46N2O2/c1-23(15-19-25-20-16-23)13-11-9-7-5-3-4-6-8-10-12-14-24(2)17-21-26-22-18-24/h3-22H2,1-2H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair
Phospholipase B (Cryptococcus neoformans)	BDBM50180991 (1,12-Bis(N-butylpyrrolidinium)dodecane dichloride ...) Show SMILES CCCC[N+]1(CCCCCCCCCCCC[N+]2(CCCC)CCCC2)CCCC1 Show InChI InChI=1S/C28H58N2/c1-3-5-21-29(25-17-18-26-29)23-15-13-11-9-7-8-10-12-14-16-24-30(22-6-4-2)27-19-20-28-30/h3-28H2,1-2H3/q+2	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Cryptococccus neoformans H99 PLB1activity				J Med Chem 49: 811-6 (2006) Article DOI: 10.1021/jm0508843 BindingDB Entry DOI: 10.7270/Q2M61JT1
					More data for this Ligand-Target Pair