Compile Data Set for Download or QSAR

Found 53 hits with Last Name = 'pavoni' and Initial = 'e'   

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
Heparanase (Homo sapiens (Human))	BDBM50466629 (CHEMBL4280766) Show SMILES [H][C@]1(O[C@H]2[C@H](O)[C@@H](OS(O)(=O)=O)[C@]([H])(O[C@@H]3[C@@H](CO)O[C@H](O[C@@H](CO)C(O[C@H](O)CO)C(O)=O)[C@H](NC(C)=O)[C@H]3O)OC2C(O)=O)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O |r| Show InChI InChI=1S/C28H46N2O26S/c1-7(35)29-13-16(39)15(38)9(3-31)49-27(13)54-21-18(41)22(56-57(46,47)48)28(55-23(21)25(44)45)53-19-10(4-32)50-26(14(17(19)40)30-8(2)36)51-11(5-33)20(24(42)43)52-12(37)6-34/h9-23,26-28,31-34,37-41H,3-6H2,1-2H3,(H,29,35)(H,30,36)(H,42,43)(H,44,45)(H,46,47,48)/t9-,10-,11+,12+,13-,14-,15-,16-,17-,18+,19-,20?,21+,22-,23?,26-,27-,28-/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466636 (CHEMBL4286441) Show SMILES OC(=O)CNC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=S)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NCC(O)=O)ccc3o2)c(F)c1 Show InChI InChI=1S/C35H26F2N6O8S/c36-21-13-19(33-40-25-9-17(1-7-27(25)50-33)11-29(44)38-15-31(46)47)3-5-23(21)42-35(52)43-24-6-4-20(14-22(24)37)34-41-26-10-18(2-8-28(26)51-34)12-30(45)39-16-32(48)49/h1-10,13-14H,11-12,15-16H2,(H,38,44)(H,39,45)(H,46,47)(H,48,49)(H2,42,43,52)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506597 (CHEMBL4576477) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3ccccc3[nH]2)cc1 Show InChI InChI=1S/C28H22BrFN4O2/c1-36-26-13-9-19(14-21(26)29)28(35)32-20-10-6-17(7-11-20)16-31-23-12-8-18(15-22(23)30)27-33-24-4-2-3-5-25(24)34-27/h2-15,31H,16H2,1H3,(H,32,35)(H,33,34)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466651 (CHEMBL4283251) Show SMILES OC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(O)=O)ccc3o2)c(F)c1 Show InChI InChI=1S/C31H20F2N4O7/c32-19-13-17(29-34-23-9-15(11-27(38)39)1-7-25(23)43-29)3-5-21(19)36-31(42)37-22-6-4-18(14-20(22)33)30-35-24-10-16(12-28(40)41)2-8-26(24)44-30/h1-10,13-14H,11-12H2,(H,38,39)(H,40,41)(H2,36,37,42)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50175811 (CHEMBL200215 | N-(4-{[4-(1H-benzoimidazol-2-yl)phe...) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2)-c2nc3ccccc3[nH]2)cc1 Show InChI InChI=1S/C28H23BrN4O2/c1-35-26-15-10-20(16-23(26)29)28(34)31-22-11-6-18(7-12-22)17-30-21-13-8-19(9-14-21)27-32-24-4-2-3-5-25(24)33-27/h2-16,30H,17H2,1H3,(H,31,34)(H,32,33)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466634 (CHEMBL4290499) Show SMILES CC(NC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NC(C)C(O)=O)ccc3o2)c(F)c1)C(O)=O Show InChI InChI=1S/C37H30F2N6O9/c1-17(35(48)49)40-31(46)13-19-3-9-29-27(11-19)42-33(53-29)21-5-7-25(23(38)15-21)44-37(52)45-26-8-6-22(16-24(26)39)34-43-28-12-20(4-10-30(28)54-34)14-32(47)41-18(2)36(50)51/h3-12,15-18H,13-14H2,1-2H3,(H,40,46)(H,41,47)(H,48,49)(H,50,51)(H2,44,45,52)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50165612 ((2-{4-[3-((E)-4-Bromo-phenyl)-acryloylamino]-pheny...) Show SMILES OC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)\C=C\c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C24H17BrN2O4/c25-18-7-1-15(2-8-18)4-12-22(28)26-19-9-5-17(6-10-19)24-27-20-13-16(14-23(29)30)3-11-21(20)31-24/h1-13H,14H2,(H,26,28)(H,29,30)/b12-4+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	420	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466633 (CHEMBL4283311) Show SMILES OC(=O)CNC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NCC(O)=O)ccc3o2)c(F)c1 Show InChI InChI=1S/C35H26F2N6O9/c36-21-13-19(33-40-25-9-17(1-7-27(25)51-33)11-29(44)38-15-31(46)47)3-5-23(21)42-35(50)43-24-6-4-20(14-22(24)37)34-41-26-10-18(2-8-28(26)52-34)12-30(45)39-16-32(48)49/h1-10,13-14H,11-12,15-16H2,(H,38,44)(H,39,45)(H,46,47)(H,48,49)(H2,42,43,50)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50175932 (1,3-bis-[4-(5,6-dimethyl-1H-benzoimidazol-2-yl)phe...) Show SMILES Cc1cc2nc([nH]c2cc1C)-c1ccc(NC(=O)Nc2ccc(cc2)-c2nc3cc(C)c(C)cc3[nH]2)cc1 Show InChI InChI=1S/C31H28N6O/c1-17-13-25-26(14-18(17)2)35-29(34-25)21-5-9-23(10-6-21)32-31(38)33-24-11-7-22(8-12-24)30-36-27-15-19(3)20(4)16-28(27)37-30/h5-16H,1-4H3,(H,34,35)(H,36,37)(H2,32,33,38)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466645 (CHEMBL4294823) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)NCC(O)=O)ccc3[nH]2)cc1 Show InChI InChI=1S/C32H27BrFN5O5/c1-44-28-11-6-21(14-23(28)33)32(43)37-22-7-2-18(3-8-22)16-35-25-10-5-20(15-24(25)34)31-38-26-9-4-19(12-27(26)39-31)13-29(40)36-17-30(41)42/h2-12,14-15,35H,13,16-17H2,1H3,(H,36,40)(H,37,43)(H,38,39)(H,41,42)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466645 (CHEMBL4294823) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)NCC(O)=O)ccc3[nH]2)cc1 Show InChI InChI=1S/C32H27BrFN5O5/c1-44-28-11-6-21(14-23(28)33)32(43)37-22-7-2-18(3-8-22)16-35-25-10-5-20(15-24(25)34)31-38-26-9-4-19(12-27(26)39-31)13-29(40)36-17-30(41)42/h2-12,14-15,35H,13,16-17H2,1H3,(H,36,40)(H,37,43)(H,38,39)(H,41,42)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	640	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466635 (CHEMBL4279847) Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NC(Cc4ccccc4)C(O)=O)ccc3o2)c(F)c1 Show InChI InChI=1S/C49H38F2N6O9/c50-33-25-31(45-54-37-21-29(11-17-41(37)65-45)23-43(58)52-39(47(60)61)19-27-7-3-1-4-8-27)13-15-35(33)56-49(64)57-36-16-14-32(26-34(36)51)46-55-38-22-30(12-18-42(38)66-46)24-44(59)53-40(48(62)63)20-28-9-5-2-6-10-28/h1-18,21-22,25-26,39-40H,19-20,23-24H2,(H,52,58)(H,53,59)(H,60,61)(H,62,63)(H2,56,57,64)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466626 (CHEMBL4289864) Show SMILES OC(=O)C(Cc1ccccc1)NC(=O)Cc1ccc2[nH]c(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NC(Cc4ccccc4)C(O)=O)ccc3[nH]2)c(F)c1 Show InChI InChI=1S/C49H40F2N8O7/c50-33-25-31(45-54-37-15-11-29(21-39(37)56-45)23-43(60)52-41(47(62)63)19-27-7-3-1-4-8-27)13-17-35(33)58-49(66)59-36-18-14-32(26-34(36)51)46-55-38-16-12-30(22-40(38)57-46)24-44(61)53-42(48(64)65)20-28-9-5-2-6-10-28/h1-18,21-22,25-26,41-42H,19-20,23-24H2,(H,52,60)(H,53,61)(H,54,56)(H,55,57)(H,62,63)(H,64,65)(H2,58,59,66)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	820	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506608 (CHEMBL4564079) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)N[C@@H](CCC(O)=O)C(O)=O)ccc3o2)cc1 |r| Show InChI InChI=1S/C35H30BrFN4O8/c1-48-29-12-6-21(16-24(29)36)33(45)39-23-7-2-19(3-8-23)18-38-26-9-5-22(17-25(26)37)34-41-28-14-20(4-11-30(28)49-34)15-31(42)40-27(35(46)47)10-13-32(43)44/h2-9,11-12,14,16-17,27,38H,10,13,15,18H2,1H3,(H,39,45)(H,40,42)(H,43,44)(H,46,47)/t27-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	820	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466632 (CHEMBL4291586) Show SMILES OC(=O)Cc1ccc2[nH]c(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(O)=O)ccc3[nH]2)c(F)c1 Show InChI InChI=1S/C31H22F2N6O5/c32-19-13-17(29-34-23-5-1-15(11-27(40)41)9-25(23)36-29)3-7-21(19)38-31(44)39-22-8-4-18(14-20(22)33)30-35-24-6-2-16(12-28(42)43)10-26(24)37-30/h1-10,13-14H,11-12H2,(H,34,36)(H,35,37)(H,40,41)(H,42,43)(H2,38,39,44)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466652 (CHEMBL4293911) Show SMILES OC(=O)Cc1ccc2[nH]c(nc2c1)-c1ccc(NC(=S)Nc2ccc(cc2F)-c2nc3cc(CC(O)=O)ccc3[nH]2)c(F)c1 Show InChI InChI=1S/C31H22F2N6O4S/c32-19-13-17(29-34-23-5-1-15(11-27(40)41)9-25(23)36-29)3-7-21(19)38-31(44)39-22-8-4-18(14-20(22)33)30-35-24-6-2-16(12-28(42)43)10-26(24)37-30/h1-10,13-14H,11-12H2,(H,34,36)(H,35,37)(H,40,41)(H,42,43)(H2,38,39,44)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	990	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506607 (CHEMBL4446276) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)NCB(O)O)ccc3[nH]2)cc1 Show InChI InChI=1S/C31H28BBrFN5O5/c1-44-28-11-6-21(14-23(28)33)31(41)37-22-7-2-18(3-8-22)16-35-25-10-5-20(15-24(25)34)30-38-26-9-4-19(12-27(26)39-30)13-29(40)36-17-32(42)43/h2-12,14-15,35,42-43H,13,16-17H2,1H3,(H,36,40)(H,37,41)(H,38,39)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.19E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506598 (CHEMBL4455617) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)NCC(O)=O)ccc3o2)cc1 Show InChI InChI=1S/C32H26BrFN4O6/c1-43-27-11-6-20(14-23(27)33)31(42)37-22-7-2-18(3-8-22)16-35-25-9-5-21(15-24(25)34)32-38-26-12-19(4-10-28(26)44-32)13-29(39)36-17-30(40)41/h2-12,14-15,35H,13,16-17H2,1H3,(H,36,39)(H,37,42)(H,40,41)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.33E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466623 (CHEMBL4295004) Show SMILES OC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=S)Nc2ccc(cc2F)-c2nc3cc(CC(O)=O)ccc3o2)c(F)c1 Show InChI InChI=1S/C31H20F2N4O6S/c32-19-13-17(29-34-23-9-15(11-27(38)39)1-7-25(23)42-29)3-5-21(19)36-31(44)37-22-6-4-18(14-20(22)33)30-35-24-10-16(12-28(40)41)2-8-26(24)43-30/h1-10,13-14H,11-12H2,(H,38,39)(H,40,41)(H2,36,37,44)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506606 (CHEMBL4467480) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)NC(Cc4ccccc4)C(O)=O)ccc3[nH]2)cc1 Show InChI InChI=1S/C39H33BrFN5O5/c1-51-35-16-11-27(20-29(35)40)38(48)43-28-12-7-24(8-13-28)22-42-31-15-10-26(21-30(31)41)37-45-32-14-9-25(18-33(32)46-37)19-36(47)44-34(39(49)50)17-23-5-3-2-4-6-23/h2-16,18,20-21,34,42H,17,19,22H2,1H3,(H,43,48)(H,44,47)(H,45,46)(H,49,50)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466640 (CHEMBL4282189) Show SMILES OC(=O)Cc1cccc(NC(=O)c2ccc(NC(=O)Nc3ccc(cc3)C(=O)Nc3cccc(CC(O)=O)c3)cc2)c1 Show InChI InChI=1S/C31H26N4O7/c36-27(37)17-19-3-1-5-25(15-19)32-29(40)21-7-11-23(12-8-21)34-31(42)35-24-13-9-22(10-14-24)30(41)33-26-6-2-4-20(16-26)18-28(38)39/h1-16H,17-18H2,(H,32,40)(H,33,41)(H,36,37)(H,38,39)(H2,34,35,42)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.76E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466631 (CHEMBL4287084) Show SMILES OC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=S)Nc2ccc(cc2)-c2nc3cc(CC(O)=O)ccc3o2)cc1 Show InChI InChI=1S/C31H22N4O6S/c36-27(37)15-17-1-11-25-23(13-17)34-29(40-25)19-3-7-21(8-4-19)32-31(42)33-22-9-5-20(6-10-22)30-35-24-14-18(16-28(38)39)2-12-26(24)41-30/h1-14H,15-16H2,(H,36,37)(H,38,39)(H2,32,33,42)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.81E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506599 (CHEMBL4569106) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)N[C@@H](C)C(O)=O)ccc3o2)cc1 |r| Show InChI InChI=1S/C33H28BrFN4O6/c1-18(33(42)43)37-30(40)14-20-5-11-29-27(13-20)39-32(45-29)22-6-10-26(25(35)16-22)36-17-19-3-8-23(9-4-19)38-31(41)21-7-12-28(44-2)24(34)15-21/h3-13,15-16,18,36H,14,17H2,1-2H3,(H,37,40)(H,38,41)(H,42,43)/t18-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.29E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506603 (CHEMBL4546209) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(O)=O)ccc3o2)cc1 Show InChI InChI=1S/C30H23BrFN3O5/c1-39-26-11-6-19(14-22(26)31)29(38)34-21-7-2-17(3-8-21)16-33-24-9-5-20(15-23(24)32)30-35-25-12-18(13-28(36)37)4-10-27(25)40-30/h2-12,14-15,33H,13,16H2,1H3,(H,34,38)(H,36,37)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466641 (CHEMBL4285613) Show SMILES OC(=O)Cc1cccc(NC(=O)c2ccc(NC(=S)Nc3ccc(cc3F)C(=O)Nc3cccc(CC(O)=O)c3)c(F)c2)c1 Show InChI InChI=1S/C31H24F2N4O6S/c32-23-15-19(29(42)34-21-5-1-3-17(11-21)13-27(38)39)7-9-25(23)36-31(44)37-26-10-8-20(16-24(26)33)30(43)35-22-6-2-4-18(12-22)14-28(40)41/h1-12,15-16H,13-14H2,(H,34,42)(H,35,43)(H,38,39)(H,40,41)(H2,36,37,44)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506595 (CHEMBL4558464) Show SMILES OC(=O)Cc1ccc2oc(nc2c1)-c1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(O)=O)ccc3o2)cc1 Show InChI InChI=1S/C31H22FN3O6/c32-22-15-21(31-35-25-12-19(14-29(38)39)4-10-27(25)41-31)7-8-23(22)33-16-17-1-5-20(6-2-17)30-34-24-11-18(13-28(36)37)3-9-26(24)40-30/h1-12,15,33H,13-14,16H2,(H,36,37)(H,38,39)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466653 (CHEMBL4281567) Show SMILES OC(=O)Cc1ccc(O)c(NC(=O)c2ccc(NC(=O)Nc3ccc(cc3)C(=O)Nc3cc(CC(O)=O)ccc3O)cc2)c1 Show InChI InChI=1S/C31H26N4O9/c36-25-11-1-17(15-27(38)39)13-23(25)34-29(42)19-3-7-21(8-4-19)32-31(44)33-22-9-5-20(6-10-22)30(43)35-24-14-18(16-28(40)41)2-12-26(24)37/h1-14,36-37H,15-16H2,(H,34,42)(H,35,43)(H,38,39)(H,40,41)(H2,32,33,44)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.73E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466625 (CHEMBL4284206) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(O)=O)ccc3[nH]2)cc1 Show InChI InChI=1S/C30H24BrFN4O4/c1-40-27-11-6-20(14-22(27)31)30(39)34-21-7-2-17(3-8-21)16-33-24-10-5-19(15-23(24)32)29-35-25-9-4-18(13-28(37)38)12-26(25)36-29/h2-12,14-15,33H,13,16H2,1H3,(H,34,39)(H,35,36)(H,37,38)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466625 (CHEMBL4284206) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(O)=O)ccc3[nH]2)cc1 Show InChI InChI=1S/C30H24BrFN4O4/c1-40-27-11-6-20(14-22(27)31)30(39)34-21-7-2-17(3-8-21)16-33-24-10-5-19(15-23(24)32)29-35-25-9-4-18(13-28(37)38)12-26(25)36-29/h2-12,14-15,33H,13,16H2,1H3,(H,34,39)(H,35,36)(H,37,38)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466630 (CHEMBL4284734) Show SMILES OC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2)-c2nc3cc(CC(O)=O)ccc3o2)cc1 Show InChI InChI=1S/C31H22N4O7/c36-27(37)15-17-1-11-25-23(13-17)34-29(41-25)19-3-7-21(8-4-19)32-31(40)33-22-9-5-20(6-10-22)30-35-24-14-18(16-28(38)39)2-12-26(24)42-30/h1-14H,15-16H2,(H,36,37)(H,38,39)(H2,32,33,40)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506596 (CHEMBL4552505) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)NC(C)C(O)=O)ccc3[nH]2)cc1 Show InChI InChI=1S/C33H29BrFN5O5/c1-18(33(43)44)37-30(41)14-20-5-10-27-28(13-20)40-31(39-27)21-6-11-26(25(35)16-21)36-17-19-3-8-23(9-4-19)38-32(42)22-7-12-29(45-2)24(34)15-22/h3-13,15-16,18,36H,14,17H2,1-2H3,(H,37,41)(H,38,42)(H,39,40)(H,43,44)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466647 (CHEMBL4290097) Show SMILES CC(C)CC(NC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NC(CC(C)C)B(O)O)ccc3o2)c(F)c1)B(O)O Show InChI InChI=1S/C41H44B2F2N6O9/c1-21(2)13-35(42(55)56)50-37(52)17-23-5-11-33-31(15-23)46-39(59-33)25-7-9-29(27(44)19-25)48-41(54)49-30-10-8-26(20-28(30)45)40-47-32-16-24(6-12-34(32)60-40)18-38(53)51-36(43(57)58)14-22(3)4/h5-12,15-16,19-22,35-36,55-58H,13-14,17-18H2,1-4H3,(H,50,52)(H,51,53)(H2,48,49,54)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506600 (CHEMBL4517524) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)N[C@@H](Cc4ccccc4)C(O)=O)ccc3o2)cc1 |r| Show InChI InChI=1S/C39H32BrFN4O6/c1-50-34-16-11-26(20-29(34)40)37(47)43-28-12-7-24(8-13-28)22-42-31-14-10-27(21-30(31)41)38-45-32-18-25(9-15-35(32)51-38)19-36(46)44-33(39(48)49)17-23-5-3-2-4-6-23/h2-16,18,20-21,33,42H,17,19,22H2,1H3,(H,43,47)(H,44,46)(H,48,49)/t33-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466627 (CHEMBL4283727) Show SMILES OC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=N)Nc2ccc(cc2)-c2nc3cc(CC(O)=O)ccc3o2)cc1 Show InChI InChI=1S/C31H23N5O6/c32-31(33-21-7-3-19(4-8-21)29-35-23-13-17(15-27(37)38)1-11-25(23)41-29)34-22-9-5-20(6-10-22)30-36-24-14-18(16-28(39)40)2-12-26(24)42-30/h1-14H,15-16H2,(H,37,38)(H,39,40)(H3,32,33,34)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466650 (CHEMBL4278721) Show SMILES OC(=O)c1cccc(NC(=O)c2ccc(NC(=O)Nc3ccc(cc3)C(=O)Nc3cccc(c3)C(O)=O)cc2)c1 Show InChI InChI=1S/C29H22N4O7/c34-25(30-23-5-1-3-19(15-23)27(36)37)17-7-11-21(12-8-17)32-29(40)33-22-13-9-18(10-14-22)26(35)31-24-6-2-4-20(16-24)28(38)39/h1-16H,(H,30,34)(H,31,35)(H,36,37)(H,38,39)(H2,32,33,40)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.17E+3	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506605 (CHEMBL4559163) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2)-c2nc3cc(CC(O)=O)ccc3[nH]2)cc1 Show InChI InChI=1S/C30H25BrN4O4/c1-39-27-13-7-21(16-24(27)31)30(38)33-23-8-2-18(3-9-23)17-32-22-10-5-20(6-11-22)29-34-25-12-4-19(15-28(36)37)14-26(25)35-29/h2-14,16,32H,15,17H2,1H3,(H,33,38)(H,34,35)(H,36,37)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506604 (CHEMBL4551505) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2)-c2nc3cc(CC(O)=O)ccc3o2)cc1 Show InChI InChI=1S/C30H24BrN3O5/c1-38-26-13-7-21(16-24(26)31)29(37)33-23-8-2-18(3-9-23)17-32-22-10-5-20(6-11-22)30-34-25-14-19(15-28(35)36)4-12-27(25)39-30/h2-14,16,32H,15,17H2,1H3,(H,33,37)(H,35,36)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506602 (CHEMBL4456621) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)NCB(O)O)ccc3o2)cc1 Show InChI InChI=1S/C31H27BBrFN4O6/c1-43-27-11-6-20(14-23(27)33)30(40)37-22-7-2-18(3-8-22)16-35-25-9-5-21(15-24(25)34)31-38-26-12-19(4-10-28(26)44-31)13-29(39)36-17-32(41)42/h2-12,14-15,35,41-42H,13,16-17H2,1H3,(H,36,39)(H,37,40)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50506601 (CHEMBL4574859) Show SMILES COc1ccc(cc1Br)C(=O)Nc1ccc(CNc2ccc(cc2F)-c2nc3cc(CC(=O)N[C@@H](CCCCN)C(O)=O)ccc3o2)cc1 |r| Show InChI InChI=1S/C36H35BrFN5O6/c1-48-31-14-9-23(18-26(31)37)34(45)41-25-10-5-21(6-11-25)20-40-28-12-8-24(19-27(28)38)35-43-30-16-22(7-13-32(30)49-35)17-33(44)42-29(36(46)47)4-2-3-15-39/h5-14,16,18-19,29,40H,2-4,15,17,20,39H2,1H3,(H,41,45)(H,42,44)(H,46,47)/t29-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE GS3 (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 based colorimetry				J Med Chem 61: 6918-6936 (2018) Article DOI: 10.1021/acs.jmedchem.8b00908 BindingDB Entry DOI: 10.7270/Q2MS3X1W
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466656 (CHEMBL4294321) Show SMILES OB(O)CNC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NCB(O)O)ccc3o2)c(F)c1 Show InChI InChI=1S/C33H28B2F2N6O9/c36-21-13-19(31-40-25-9-17(1-7-27(25)51-31)11-29(44)38-15-34(47)48)3-5-23(21)42-33(46)43-24-6-4-20(14-22(24)37)32-41-26-10-18(2-8-28(26)52-32)12-30(45)39-16-35(49)50/h1-10,13-14,47-50H,11-12,15-16H2,(H,38,44)(H,39,45)(H2,42,43,46)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466655 (CHEMBL4282230) Show SMILES CC(C)CCNC(=O)Cc1ccc2oc(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NCCC(C)C)ccc3o2)c(F)c1 Show InChI InChI=1S/C41H42F2N6O5/c1-23(2)13-15-44-37(50)19-25-5-11-35-33(17-25)46-39(53-35)27-7-9-31(29(42)21-27)48-41(52)49-32-10-8-28(22-30(32)43)40-47-34-18-26(6-12-36(34)54-40)20-38(51)45-16-14-24(3)4/h5-12,17-18,21-24H,13-16,19-20H2,1-4H3,(H,44,50)(H,45,51)(H2,48,49,52)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466654 (CHEMBL4293844) Show SMILES OC(=O)Cc1ccc2oc(nc2c1)-c1cccc(NC(=O)Nc2cccc(c2)-c2nc3cc(CC(O)=O)ccc3o2)c1 Show InChI InChI=1S/C31H22N4O7/c36-27(37)13-17-7-9-25-23(11-17)34-29(41-25)19-3-1-5-21(15-19)32-31(40)33-22-6-2-4-20(16-22)30-35-24-12-18(14-28(38)39)8-10-26(24)42-30/h1-12,15-16H,13-14H2,(H,36,37)(H,38,39)(H2,32,33,40)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466649 (CHEMBL4290068) Show SMILES OC(=O)Cc1cccc(NS(=O)(=O)c2ccc(NC(=O)Nc3ccc(cc3)S(=O)(=O)Nc3cccc(CC(O)=O)c3)cc2)c1 Show InChI InChI=1S/C29H26N4O9S2/c34-27(35)17-19-3-1-5-23(15-19)32-43(39,40)25-11-7-21(8-12-25)30-29(38)31-22-9-13-26(14-10-22)44(41,42)33-24-6-2-4-20(16-24)18-28(36)37/h1-16,32-33H,17-18H2,(H,34,35)(H,36,37)(H2,30,31,38)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466648 (CHEMBL4286030) Show SMILES Cc1cc2nc(oc2cc1C)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(C)c(C)cc3o2)c(F)c1 Show InChI InChI=1S/C31H24F2N4O3/c1-15-9-25-27(11-17(15)3)39-29(34-25)19-5-7-23(21(32)13-19)36-31(38)37-24-8-6-20(14-22(24)33)30-35-26-10-16(2)18(4)12-28(26)40-30/h5-14H,1-4H3,(H2,36,37,38)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466646 (CHEMBL4293867) Show SMILES OC(Cc1ccc(cc1)C(=O)Nc1cccc(CC(O)=O)c1)Cc1ccc(cc1)C(=O)Nc1cccc(CC(O)=O)c1 Show InChI InChI=1S/C33H30N2O7/c36-29(17-21-7-11-25(12-8-21)32(41)34-27-5-1-3-23(15-27)19-30(37)38)18-22-9-13-26(14-10-22)33(42)35-28-6-2-4-24(16-28)20-31(39)40/h1-16,29,36H,17-20H2,(H,34,41)(H,35,42)(H,37,38)(H,39,40)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466644 (CHEMBL4286630) Show SMILES OB(O)c1cccc(NC(=O)c2ccc(NC(=O)Nc3ccc(cc3)C(=O)Nc3cccc(c3)B(O)O)cc2)c1 Show InChI InChI=1S/C27H24B2N4O7/c34-25(30-23-5-1-3-19(15-23)28(37)38)17-7-11-21(12-8-17)32-27(36)33-22-13-9-18(10-14-22)26(35)31-24-6-2-4-20(16-24)29(39)40/h1-16,37-40H,(H,30,34)(H,31,35)(H2,32,33,36)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466643 (CHEMBL4283274) Show SMILES OC(=O)Cc1cccc(NC(=O)c2ccc(CC(=O)Cc3ccc(cc3)C(=O)Nc3cccc(CC(O)=O)c3)cc2)c1 Show InChI InChI=1S/C33H28N2O7/c36-29(17-21-7-11-25(12-8-21)32(41)34-27-5-1-3-23(15-27)19-30(37)38)18-22-9-13-26(14-10-22)33(42)35-28-6-2-4-24(16-28)20-31(39)40/h1-16H,17-20H2,(H,34,41)(H,35,42)(H,37,38)(H,39,40)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466642 (CHEMBL4293452) Show SMILES OC(Cc1ccc(cc1)C(=O)Nc1cc(CC(O)=O)ccc1O)Cc1ccc(cc1)C(=O)Nc1cc(CC(O)=O)ccc1O Show InChI InChI=1S/C33H30N2O9/c36-25(13-19-1-7-23(8-2-19)32(43)34-26-15-21(17-30(39)40)5-11-28(26)37)14-20-3-9-24(10-4-20)33(44)35-27-16-22(18-31(41)42)6-12-29(27)38/h1-12,15-16,25,36-38H,13-14,17-18H2,(H,34,43)(H,35,44)(H,39,40)(H,41,42)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466639 (CHEMBL4289453) Show SMILES Cc1cc2nc(oc2cc1C)N1CCC(CC1)NC(=O)NC1CCN(CC1)c1nc2cc(C)c(C)cc2o1 Show InChI InChI=1S/C29H36N6O3/c1-17-13-23-25(15-19(17)3)37-28(32-23)34-9-5-21(6-10-34)30-27(36)31-22-7-11-35(12-8-22)29-33-24-14-18(2)20(4)16-26(24)38-29/h13-16,21-22H,5-12H2,1-4H3,(H2,30,31,36)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair
Heparanase (Homo sapiens (Human))	BDBM50466638 (CHEMBL4282650) Show SMILES OB(O)CNC(=O)Cc1ccc2[nH]c(nc2c1)-c1ccc(NC(=O)Nc2ccc(cc2F)-c2nc3cc(CC(=O)NCB(O)O)ccc3[nH]2)c(F)c1 Show InChI InChI=1S/C33H30B2F2N8O7/c36-21-13-19(31-40-25-5-1-17(9-27(25)42-31)11-29(46)38-15-34(49)50)3-7-23(21)44-33(48)45-24-8-4-20(14-22(24)37)32-41-26-6-2-18(10-28(26)43-32)12-30(47)39-16-35(51)52/h1-10,13-14,49-52H,11-12,15-16H2,(H,38,46)(H,39,47)(H,40,42)(H,41,43)(H2,44,45,48)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
"Sapienza" Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of recombinant HPSE (unknown origin) using fondaparinux as substrate incubated for 3 hrs in absence of light by WST1 assay				J Med Chem 61: 10834-10859 (2018) Article DOI: 10.1021/acs.jmedchem.8b01497 BindingDB Entry DOI: 10.7270/Q29K4DWD
					More data for this Ligand-Target Pair

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