Compile Data Set for Download or QSAR

Found 85 hits Enz. Inhib. hit(s) with Target = 'Cysteine proteinase falcipain 3'   

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
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50448248 (CHEMBL3120847) Show SMILES OCC(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C24H28N2O6/c27-15-22(29)20(12-11-17-7-3-1-4-8-17)25-23(30)21-13-19(28)14-26(21)24(31)32-16-18-9-5-2-6-10-18/h1-10,19-21,27-28H,11-16H2,(H,25,30)/t19-,20+,21+/m1/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
University of Mississippi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum cysteine protease falcipain-3				Bioorg Med Chem Lett 24: 1274-9 (2014) Article DOI: 10.1016/j.bmcl.2014.01.062 BindingDB Entry DOI: 10.7270/Q26Q1ZRJ
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513155 (CHEMBL4434685) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C1CCN(C)CC1 |r,t:8| Show InChI InChI=1S/C38H54N6O6.C2HF3O2/c1-23(2)18-30(42-38(49)31(19-24(3)4)41-36(47)26-14-16-43(6)17-15-26)37(48)40-25(5)12-13-34(45)44-32(33(50-7)21-35(44)46)20-27-22-39-29-11-9-8-10-28(27)29;3-2(4,5)1(6)7/h8-13,21-26,30-32,39H,14-20H2,1-7H3,(H,40,48)(H,41,47)(H,42,49);(H,6,7)/b13-12+;/t25-,30-,31-,32-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50286441 ((S)-2-((S)-2-Acetylamino-4-(S)-methyl-pentanoylami...) Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O Show InChI InChI=1S/C20H38N6O5/c1-11(2)9-15(24-13(5)27)17(28)26-16(10-12(3)4)18(29)25-14(19(30)31)7-6-8-23-20(21)22/h11-12,14-16H,6-10H2,1-5H3,(H,24,27)(H,25,29)(H,26,28)(H,30,31)(H4,21,22,23)/t14-,15-,16-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	87	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Allergy and Infectious Diseases Curated by ChEMBL					Assay Description Inhibition of Cysteine protease falcipain-3 in Plasmodium falciparum HB3 infected erythrocytes by Z-Phe-Arg-AMC substrate hydrolysis assay				Antimicrob Agents Chemother 52: 2346-54 (2008) Article DOI: 10.1128/AAC.00057-08 BindingDB Entry DOI: 10.7270/Q2WH2Q8W
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50286441 ((S)-2-((S)-2-Acetylamino-4-(S)-methyl-pentanoylami...) Show SMILES CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O Show InChI InChI=1S/C20H38N6O5/c1-11(2)9-15(24-13(5)27)17(28)26-16(10-12(3)4)18(29)25-14(19(30)31)7-6-8-23-20(21)22/h11-12,14-16H,6-10H2,1-5H3,(H,24,27)(H,25,29)(H,26,28)(H,30,31)(H4,21,22,23)/t14-,15-,16-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	98	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Allergy and Infectious Diseases Curated by ChEMBL					Assay Description Inhibition of Cysteine protease falcipain-3 in Plasmodium falciparum HB3-leuR1 mutant infected erythrocytes by Z-Phe-Arg-AMC substrate hydrolysis ass...				Antimicrob Agents Chemother 52: 2346-54 (2008) Article DOI: 10.1128/AAC.00057-08 BindingDB Entry DOI: 10.7270/Q2WH2Q8W
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513158 (CHEMBL4439637) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| Show InChI InChI=1S/C45H62N6O6.C2HF3O2/c1-28(2)23-36(48-44(55)37(24-29(3)4)49-45(56)42(30(5)6)50(7)8)43(54)47-33(20-19-31-15-11-10-12-16-31)21-22-40(52)51-38(39(57-9)26-41(51)53)25-32-27-46-35-18-14-13-17-34(32)35;3-2(4,5)1(6)7/h10-18,21-22,26-30,33,36-38,42,46H,19-20,23-25H2,1-9H3,(H,47,54)(H,48,55)(H,49,56);(H,6,7)/b22-21+;/t33-,36-,37-,38-,42-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	112	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50461247 (CHEMBL4228861) Show SMILES O=C(NC1(CC1)C#N)[C@H](Cc1cccnc1)NC(=O)c1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C25H22N4O2/c26-17-25(12-13-25)29-24(31)22(15-18-5-4-14-27-16-18)28-23(30)21-10-8-20(9-11-21)19-6-2-1-3-7-19/h1-11,14,16,22H,12-13,15H2,(H,28,30)(H,29,31)/t22-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	117	n/a	n/a	n/a	n/a	n/a	n/a
IRBM Science Park Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3				Bioorg Med Chem Lett 28: 1540-1544 (2018) Article DOI: 10.1016/j.bmcl.2018.03.069 BindingDB Entry DOI: 10.7270/Q2G44SW1
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513162 (CHEMBL4467013) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1CCCCC1)NC(=O)C1CCN(C)CC1 |r,t:8| Show InChI InChI=1S/C41H58N6O6.C2HF3O2/c1-26(2)21-33(45-41(52)34(22-28-11-7-6-8-12-28)44-39(50)29-17-19-46(4)20-18-29)40(51)43-27(3)15-16-37(48)47-35(36(53-5)24-38(47)49)23-30-25-42-32-14-10-9-13-31(30)32;3-2(4,5)1(6)7/h9-10,13-16,24-29,33-35,42H,6-8,11-12,17-23H2,1-5H3,(H,43,51)(H,44,50)(H,45,52);(H,6,7)/b16-15+;/t27-,33-,34-,35-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	117	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513161 (CHEMBL4472824) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| Show InChI InChI=1S/C41H60N6O6.C2HF3O2/c1-25(2)20-32(44-40(51)33(21-28-14-10-9-11-15-28)45-41(52)38(26(3)4)46(6)7)39(50)43-27(5)18-19-36(48)47-34(35(53-8)23-37(47)49)22-29-24-42-31-17-13-12-16-30(29)31;3-2(4,5)1(6)7/h12-13,16-19,23-28,32-34,38,42H,9-11,14-15,20-22H2,1-8H3,(H,43,50)(H,44,51)(H,45,52);(H,6,7)/b19-18+;/t27-,32-,33-,34-,38-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	131	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM12042 ((2R,3R)-3-{[(1S)-1-[(4-carbamimidamidobutyl)carbam...) Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H]-1-[#8]-[#6@H]-1-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r| Show InChI InChI=1S/C15H27N5O5/c1-8(2)7-9(20-13(22)10-11(25-10)14(23)24)12(21)18-5-3-4-6-19-15(16)17/h8-11H,3-7H2,1-2H3,(H,18,21)(H,20,22)(H,23,24)(H4,16,17,19)/t9-,10+,11+/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	136	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513163 (CHEMBL4442854) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| Show InChI InChI=1S/C42H56N6O6.C2HF3O2/c1-26(2)22-34(46-40(51)33(20-19-29-14-10-9-11-15-29)45-42(53)39(27(3)4)47(6)7)41(52)44-28(5)18-21-37(49)48-35(36(54-8)24-38(48)50)23-30-25-43-32-17-13-12-16-31(30)32;3-2(4,5)1(6)7/h9-18,21,24-28,33-35,39,43H,19-20,22-23H2,1-8H3,(H,44,52)(H,45,53)(H,46,51);(H,6,7)/b21-18+;/t28-,33-,34-,35-,39-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	228	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513168 (CHEMBL4437416) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| Show InChI InChI=1S/C41H60N6O6.C2HF3O2/c1-25(2)20-32(45-41(52)38(26(3)4)46(6)7)40(51)44-33(21-28-14-10-9-11-15-28)39(50)43-27(5)18-19-36(48)47-34(35(53-8)23-37(47)49)22-29-24-42-31-17-13-12-16-30(29)31;3-2(4,5)1(6)7/h12-13,16-19,23-28,32-34,38,42H,9-11,14-15,20-22H2,1-8H3,(H,43,50)(H,44,51)(H,45,52);(H,6,7)/b19-18+;/t27-,32-,33-,34-,38-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	407	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513165 (CHEMBL4475837) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| Show InChI InChI=1S/C44H64N6O6.C2HF3O2/c1-28(2)41(49(4)5)44(55)48-36(24-31-17-11-8-12-18-31)43(54)47-35(23-30-15-9-7-10-16-30)42(53)46-29(3)21-22-39(51)50-37(38(56-6)26-40(50)52)25-32-27-45-34-20-14-13-19-33(32)34;3-2(4,5)1(6)7/h13-14,19-22,26-31,35-37,41,45H,7-12,15-18,23-25H2,1-6H3,(H,46,53)(H,47,54)(H,48,55);(H,6,7)/b22-21+;/t29-,35-,36-,37-,41-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	459	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513166 (CHEMBL4527228) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)C1CCN(C)CC1 |r,t:8| Show InChI InChI=1S/C41H58N6O6.C2HF3O2/c1-26(2)21-33(44-39(50)29-17-19-46(4)20-18-29)41(52)45-34(22-28-11-7-6-8-12-28)40(51)43-27(3)15-16-37(48)47-35(36(53-5)24-38(47)49)23-30-25-42-32-14-10-9-13-31(30)32;3-2(4,5)1(6)7/h9-10,13-16,24-29,33-35,42H,6-8,11-12,17-23H2,1-5H3,(H,43,51)(H,44,50)(H,45,52);(H,6,7)/b16-15+;/t27-,33-,34-,35-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	480	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50157741 (CHEMBL374508 | E-64 | E64) Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H]-1-[#8]-[#6@@H]-1-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7] |r| Show InChI InChI=1S/C15H27N5O5/c1-8(2)7-9(20-13(22)10-11(25-10)14(23)24)12(21)18-5-3-4-6-19-15(16)17/h8-11H,3-7H2,1-2H3,(H,18,21)(H,20,22)(H,23,24)(H4,16,17,19)/t9-,10-,11-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	482	n/a	n/a	n/a	n/a	n/a	n/a
University of Lisbon Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain 3 incubated with compound for 10 mins before addition of 25 uM Z-Leu-Arg-AMC substrate by fluorescence ...				Eur J Med Chem 46: 927-33 (2011) Article DOI: 10.1016/j.ejmech.2011.01.008 BindingDB Entry DOI: 10.7270/Q2ZC8345
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513156 (CHEMBL4442674) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)N(C)C)C1CCCCC1 |r,t:8| Show InChI InChI=1S/C43H64N6O6.C2HF3O2/c1-26(2)21-34(46-42(53)35(22-27(3)4)47-43(54)40(28(5)6)48(7)8)41(52)45-32(29-15-11-10-12-16-29)19-20-38(50)49-36(37(55-9)24-39(49)51)23-30-25-44-33-18-14-13-17-31(30)33;3-2(4,5)1(6)7/h13-14,17-20,24-29,32,34-36,40,44H,10-12,15-16,21-23H2,1-9H3,(H,45,52)(H,46,53)(H,47,54);(H,6,7)/b20-19+;/t32-,34+,35+,36+,40+;/m1./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	484	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513159 (CHEMBL4516951) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](C(C)C)N(C)C)C1CCCCC1 |r,t:8| Show InChI InChI=1S/C46H68N6O6.C2HF3O2/c1-29(2)24-37(49-45(56)38(25-31-16-10-8-11-17-31)50-46(57)43(30(3)4)51(5)6)44(55)48-35(32-18-12-9-13-19-32)22-23-41(53)52-39(40(58-7)27-42(52)54)26-33-28-47-36-21-15-14-20-34(33)36;3-2(4,5)1(6)7/h14-15,20-23,27-32,35,37-39,43,47H,8-13,16-19,24-26H2,1-7H3,(H,48,55)(H,49,56)(H,50,57);(H,6,7)/b23-22+;/t35-,37+,38+,39+,43+;/m1./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	490	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50448247 (CHEMBL3120848) Show SMILES O[C@@H]1C[C@H](N(C1)C(=O)OCc1ccccc1)C(=O)N[C@@H](CCc1ccccc1)C(=O)CSCCCc1ccccc1 |r| Show InChI InChI=1S/C33H38N2O5S/c36-28-21-30(35(22-28)33(39)40-23-27-15-8-3-9-16-27)32(38)34-29(19-18-26-13-6-2-7-14-26)31(37)24-41-20-10-17-25-11-4-1-5-12-25/h1-9,11-16,28-30,36H,10,17-24H2,(H,34,38)/t28-,29+,30+/m1/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	n/a	n/a
University of Mississippi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum cysteine protease falcipain-3				Bioorg Med Chem Lett 24: 1274-9 (2014) Article DOI: 10.1016/j.bmcl.2014.01.062 BindingDB Entry DOI: 10.7270/Q26Q1ZRJ
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50448261 (CHEMBL3120834) Show SMILES OCC(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C26H32N2O5/c29-17-24(30)23(16-15-19-9-3-1-4-10-19)27-25(31)21-13-7-8-14-22(21)28-26(32)33-18-20-11-5-2-6-12-20/h1-6,9-12,21-23,29H,7-8,13-18H2,(H,27,31)(H,28,32)/t21-,22+,23+/m1/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
University of Mississippi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum cysteine protease falcipain-3				Bioorg Med Chem Lett 24: 1274-9 (2014) Article DOI: 10.1016/j.bmcl.2014.01.062 BindingDB Entry DOI: 10.7270/Q26Q1ZRJ
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513157 (CHEMBL4555968) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC1CCCCC1)NC(=O)C1CCN(C)CC1 |r,t:8| Show InChI InChI=1S/C44H62N6O6.C2HF3O2/c1-29(18-19-40(51)50-38(39(56-3)27-41(50)52)26-33-28-45-35-17-11-10-16-34(33)35)46-43(54)36(24-30-12-6-4-7-13-30)48-44(55)37(25-31-14-8-5-9-15-31)47-42(53)32-20-22-49(2)23-21-32;3-2(4,5)1(6)7/h10-11,16-19,27-32,36-38,45H,4-9,12-15,20-26H2,1-3H3,(H,46,54)(H,47,53)(H,48,55);(H,6,7)/b19-18+;/t29-,36-,37-,38-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	547	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513167 (CHEMBL4564002) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| Show InChI InChI=1S/C41H54N6O6.C2HF3O2/c1-25(2)20-32(44-40(51)33(21-28-14-10-9-11-15-28)45-41(52)38(26(3)4)46(6)7)39(50)43-27(5)18-19-36(48)47-34(35(53-8)23-37(47)49)22-29-24-42-31-17-13-12-16-30(29)31;3-2(4,5)1(6)7/h9-19,23-27,32-34,38,42H,20-22H2,1-8H3,(H,43,50)(H,44,51)(H,45,52);(H,6,7)/b19-18+;/t27-,32-,33-,34-,38-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	851	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50448260 (CHEMBL3120835) Show SMILES OCC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H]1CCCC[C@H]1NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C26H32N2O5/c29-17-24(30)23(16-15-19-9-3-1-4-10-19)27-25(31)21-13-7-8-14-22(21)28-26(32)33-18-20-11-5-2-6-12-20/h1-6,9-12,21-23,29H,7-8,13-18H2,(H,27,31)(H,28,32)/t21-,22+,23-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
University of Mississippi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum cysteine protease falcipain-3				Bioorg Med Chem Lett 24: 1274-9 (2014) Article DOI: 10.1016/j.bmcl.2014.01.062 BindingDB Entry DOI: 10.7270/Q26Q1ZRJ
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513160 (CHEMBL4456644) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| Show InChI InChI=1S/C44H66N6O6.C2HF3O2/c1-27(2)21-35(47-43(54)36(22-28(3)4)48-44(55)41(29(5)6)49(7)8)42(53)46-32(23-30-15-11-10-12-16-30)19-20-39(51)50-37(38(56-9)25-40(50)52)24-31-26-45-34-18-14-13-17-33(31)34;3-2(4,5)1(6)7/h13-14,17-20,25-30,32,35-37,41,45H,10-12,15-16,21-24H2,1-9H3,(H,46,53)(H,47,54)(H,48,55);(H,6,7)/b20-19+;/t32-,35+,36+,37+,41+;/m1./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.57E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50448246 (CHEMBL3120849) Show SMILES CC(=O)SCC(=O)[C@H](CCc1ccccc1)NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C26H30N2O6S/c1-18(29)35-17-24(31)22(13-12-19-8-4-2-5-9-19)27-25(32)23-14-21(30)15-28(23)26(33)34-16-20-10-6-3-7-11-20/h2-11,21-23,30H,12-17H2,1H3,(H,27,32)/t21-,22+,23+/m1/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mississippi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum cysteine protease falcipain-3				Bioorg Med Chem Lett 24: 1274-9 (2014) Article DOI: 10.1016/j.bmcl.2014.01.062 BindingDB Entry DOI: 10.7270/Q26Q1ZRJ
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529716 (CHEMBL1584095) Show SMILES Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2NC(=O)c2ccccc2F)no1 Show InChI InChI=1S/C20H16FN7O3/c1-12-10-17(26-31-12)23-18(29)11-28-25-19(24-27-28)14-7-3-5-9-16(14)22-20(30)13-6-2-4-8-15(13)21/h2-10H,11H2,1H3,(H,22,30)(H,23,26,29)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529715 (CHEMBL4471644) Show SMILES Cc1cc(NC(=O)Cn2nnc(n2)-c2ccc(N)cc2)no1 Show InChI InChI=1S/C13H13N7O2/c1-8-6-11(18-22-8)15-12(21)7-20-17-13(16-19-20)9-2-4-10(14)5-3-9/h2-6H,7,14H2,1H3,(H,15,18,21)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529714 (CHEMBL4458321) Show SMILES CCCCOc1ccc(cc1)-c1nnn(CC(=O)c2ccc(Cl)cc2)n1 Show InChI InChI=1S/C19H19ClN4O2/c1-2-3-12-26-17-10-6-15(7-11-17)19-21-23-24(22-19)13-18(25)14-4-8-16(20)9-5-14/h4-11H,2-3,12-13H2,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529713 (CHEMBL4449400) Show SMILES COc1ccc(NC(=O)Cn2nnc(n2)-c2ccccc2NS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1 Show InChI InChI=1S/C24H23N7O5S/c1-16(32)25-17-9-13-20(14-10-17)37(34,35)29-22-6-4-3-5-21(22)24-27-30-31(28-24)15-23(33)26-18-7-11-19(36-2)12-8-18/h3-14,29H,15H2,1-2H3,(H,25,32)(H,26,33)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529722 (CHEMBL4582464) Show SMILES CC(C(=O)N1c2ccccc2CCc2ccccc12)n1nnc(n1)-c1ccc(cc1)N1CCOCC1 Show InChI InChI=1S/C28H28N6O2/c1-20(28(35)33-25-8-4-2-6-21(25)10-11-22-7-3-5-9-26(22)33)34-30-27(29-31-34)23-12-14-24(15-13-23)32-16-18-36-19-17-32/h2-9,12-15,20H,10-11,16-19H2,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529717 (CHEMBL4578038) Show SMILES COc1ccc(cc1)C(=O)Cn1nnc(n1)-c1ccccc1NC(=O)c1ccncc1 Show InChI InChI=1S/C22H18N6O3/c1-31-17-8-6-15(7-9-17)20(29)14-28-26-21(25-27-28)18-4-2-3-5-19(18)24-22(30)16-10-12-23-13-11-16/h2-13H,14H2,1H3,(H,24,30)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529718 (CHEMBL4582597) Show SMILES CCCCOc1ccc(cc1)-c1nnn(CC(=O)Nc2c(C)ccc3ccccc23)n1 Show InChI InChI=1S/C24H25N5O2/c1-3-4-15-31-20-13-11-19(12-14-20)24-26-28-29(27-24)16-22(30)25-23-17(2)9-10-18-7-5-6-8-21(18)23/h5-14H,3-4,15-16H2,1-2H3,(H,25,30)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529713 (CHEMBL4449400) Show SMILES COc1ccc(NC(=O)Cn2nnc(n2)-c2ccccc2NS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1 Show InChI InChI=1S/C24H23N7O5S/c1-16(32)25-17-9-13-20(14-10-17)37(34,35)29-22-6-4-3-5-21(22)24-27-30-31(28-24)15-23(33)26-18-7-11-19(36-2)12-8-18/h3-14,29H,15H2,1-2H3,(H,25,32)(H,26,33)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529715 (CHEMBL4471644) Show SMILES Cc1cc(NC(=O)Cn2nnc(n2)-c2ccc(N)cc2)no1 Show InChI InChI=1S/C13H13N7O2/c1-8-6-11(18-22-8)15-12(21)7-20-17-13(16-19-20)9-2-4-10(14)5-3-9/h2-6H,7,14H2,1H3,(H,15,18,21)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529720 (CHEMBL4551614) Show SMILES COc1ccc(cc1)-c1ccc(cc1)-c1nnn(CC(=O)c2ccccc2)n1 Show InChI InChI=1S/C22H18N4O2/c1-28-20-13-11-17(12-14-20)16-7-9-19(10-8-16)22-23-25-26(24-22)15-21(27)18-5-3-2-4-6-18/h2-14H,15H2,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529714 (CHEMBL4458321) Show SMILES CCCCOc1ccc(cc1)-c1nnn(CC(=O)c2ccc(Cl)cc2)n1 Show InChI InChI=1S/C19H19ClN4O2/c1-2-3-12-26-17-10-6-15(7-11-17)19-21-23-24(22-19)13-18(25)14-4-8-16(20)9-5-14/h4-11H,2-3,12-13H2,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529722 (CHEMBL4582464) Show SMILES CC(C(=O)N1c2ccccc2CCc2ccccc12)n1nnc(n1)-c1ccc(cc1)N1CCOCC1 Show InChI InChI=1S/C28H28N6O2/c1-20(28(35)33-25-8-4-2-6-21(25)10-11-22-7-3-5-9-26(22)33)34-30-27(29-31-34)23-12-14-24(15-13-23)32-16-18-36-19-17-32/h2-9,12-15,20H,10-11,16-19H2,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529712 (CHEMBL4451728) Show SMILES COc1ccc(NC(=O)Cn2nnc(n2)-c2ccccc2NC(=O)c2cc(OC)cc(OC)c2)cc1 Show InChI InChI=1S/C25H24N6O5/c1-34-18-10-8-17(9-11-18)26-23(32)15-31-29-24(28-30-31)21-6-4-5-7-22(21)27-25(33)16-12-19(35-2)14-20(13-16)36-3/h4-14H,15H2,1-3H3,(H,26,32)(H,27,33)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529719 (CHEMBL1302947) Show SMILES O=C(Cn1nnc(n1)-c1ccccc1)NNC(=O)c1ccco1 Show InChI InChI=1S/C14H12N6O3/c21-12(15-17-14(22)11-7-4-8-23-11)9-20-18-13(16-19-20)10-5-2-1-3-6-10/h1-8H,9H2,(H,15,21)(H,17,22)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529717 (CHEMBL4578038) Show SMILES COc1ccc(cc1)C(=O)Cn1nnc(n1)-c1ccccc1NC(=O)c1ccncc1 Show InChI InChI=1S/C22H18N6O3/c1-31-17-8-6-15(7-9-17)20(29)14-28-26-21(25-27-28)18-4-2-3-5-19(18)24-22(30)16-10-12-23-13-11-16/h2-13H,14H2,1H3,(H,24,30)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529721 (CHEMBL4444541) Show SMILES COc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnn(CC(=O)Nc2cc(C)on2)n1 Show InChI InChI=1S/C21H19N7O4/c1-13-11-18(26-32-13)23-19(29)12-28-25-20(24-27-28)14-3-7-16(8-4-14)22-21(30)15-5-9-17(31-2)10-6-15/h3-11H,12H2,1-2H3,(H,22,30)(H,23,26,29)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529712 (CHEMBL4451728) Show SMILES COc1ccc(NC(=O)Cn2nnc(n2)-c2ccccc2NC(=O)c2cc(OC)cc(OC)c2)cc1 Show InChI InChI=1S/C25H24N6O5/c1-34-18-10-8-17(9-11-18)26-23(32)15-31-29-24(28-30-31)21-6-4-5-7-22(21)27-25(33)16-12-19(35-2)14-20(13-16)36-3/h4-14H,15H2,1-3H3,(H,26,32)(H,27,33)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529719 (CHEMBL1302947) Show SMILES O=C(Cn1nnc(n1)-c1ccccc1)NNC(=O)c1ccco1 Show InChI InChI=1S/C14H12N6O3/c21-12(15-17-14(22)11-7-4-8-23-11)9-20-18-13(16-19-20)10-5-2-1-3-6-10/h1-8H,9H2,(H,15,21)(H,17,22)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529721 (CHEMBL4444541) Show SMILES COc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1nnn(CC(=O)Nc2cc(C)on2)n1 Show InChI InChI=1S/C21H19N7O4/c1-13-11-18(26-32-13)23-19(29)12-28-25-20(24-27-28)14-3-7-16(8-4-14)22-21(30)15-5-9-17(31-2)10-6-15/h3-11H,12H2,1-2H3,(H,22,30)(H,23,26,29)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529716 (CHEMBL1584095) Show SMILES Cc1cc(NC(=O)Cn2nnc(n2)-c2ccccc2NC(=O)c2ccccc2F)no1 Show InChI InChI=1S/C20H16FN7O3/c1-12-10-17(26-31-12)23-18(29)11-28-25-19(24-27-28)14-7-3-5-9-16(14)22-20(30)13-6-2-4-8-15(13)21/h2-10H,11H2,1H3,(H,22,30)(H,23,26,29)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529718 (CHEMBL4582597) Show SMILES CCCCOc1ccc(cc1)-c1nnn(CC(=O)Nc2c(C)ccc3ccccc23)n1 Show InChI InChI=1S/C24H25N5O2/c1-3-4-15-31-20-13-11-19(12-14-20)24-26-28-29(27-24)16-22(30)25-23-17(2)9-10-18-7-5-6-8-21(18)23/h5-14H,3-4,15-16H2,1-2H3,(H,25,30)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50529720 (CHEMBL4551614) Show SMILES COc1ccc(cc1)-c1ccc(cc1)-c1nnn(CC(=O)c2ccccc2)n1 Show InChI InChI=1S/C22H18N4O2/c1-28-20-13-11-17(12-14-20)16-7-9-19(10-8-16)22-23-25-26(24-22)15-21(27)18-5-3-2-4-6-18/h2-14H,15H2,1H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
WuXi AppTec Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum falcipain-3 preincubated for 30 mins followed by Z-Leu-Arg-AMC substrate addition and measured up to 15 mins by s...				Eur J Med Chem 163: 404-412 (2019) Article DOI: 10.1016/j.ejmech.2018.12.001 BindingDB Entry DOI: 10.7270/Q2348PVF
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50448253 (CHEMBL3120842) Show SMILES OCC(=O)[C@H](CCc1ccccc1)NC(=O)C1(CCSCC1)NC(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C25H30N2O5S/c28-17-22(29)21(12-11-19-7-3-1-4-8-19)26-23(30)25(13-15-33-16-14-25)27-24(31)32-18-20-9-5-2-6-10-20/h1-10,21,28H,11-18H2,(H,26,30)(H,27,31)/t21-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.22E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Mississippi Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum cysteine protease falcipain-3				Bioorg Med Chem Lett 24: 1274-9 (2014) Article DOI: 10.1016/j.bmcl.2014.01.062 BindingDB Entry DOI: 10.7270/Q26Q1ZRJ
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50538770 (CHEMBL4637201) Show SMILES O=C(NCCCNC(=O)c1ccc(cc1)-c1ccccc1)c1cc2ccccc2[nH]1 Show InChI InChI=1S/C25H23N3O2/c29-24(20-13-11-19(12-14-20)18-7-2-1-3-8-18)26-15-6-16-27-25(30)23-17-21-9-4-5-10-22(21)28-23/h1-5,7-14,17,28H,6,15-16H2,(H,26,29)(H,27,30)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shoolini University of Biotechnology and Management Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-3 expressed in bacterial expression system using ZFR-AMC as substrate measured for 30 mins ...				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2019.115155 BindingDB Entry DOI: 10.7270/Q2M3309D
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513164 (CHEMBL4594166) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| Show InChI InChI=1S/C45H60N6O6.C2HF3O2/c1-29(2)42(50(4)5)45(56)49-37(25-32-17-11-8-12-18-32)44(55)48-36(23-22-31-15-9-7-10-16-31)43(54)47-30(3)21-24-40(52)51-38(39(57-6)27-41(51)53)26-33-28-46-35-20-14-13-19-34(33)35;3-2(4,5)1(6)7/h7,9-10,13-16,19-21,24,27-30,32,36-38,42,46H,8,11-12,17-18,22-23,25-26H2,1-6H3,(H,47,54)(H,48,55)(H,49,56);(H,6,7)/b24-21+;/t30-,36-,37-,38-,42-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.79E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50538769 (CHEMBL4646055) Show SMILES CN1CCCc2cc(CCNC(=O)C(=O)Nc3ccc4OCOc4c3)ccc12 Show InChI InChI=1S/C21H23N3O4/c1-24-10-2-3-15-11-14(4-6-17(15)24)8-9-22-20(25)21(26)23-16-5-7-18-19(12-16)28-13-27-18/h4-7,11-12H,2-3,8-10,13H2,1H3,(H,22,25)(H,23,26)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.98E+3	n/a	n/a	n/a	n/a	n/a	n/a
Shoolini University of Biotechnology and Management Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-3 expressed in bacterial expression system using ZFR-AMC as substrate measured for 30 mins ...				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2019.115155 BindingDB Entry DOI: 10.7270/Q2M3309D
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513170 (CHEMBL4473513) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CCc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| Show InChI InChI=1S/C42H56N6O6.C2HF3O2/c1-26(2)22-34(46-42(53)39(27(3)4)47(6)7)41(52)45-33(20-19-29-14-10-9-11-15-29)40(51)44-28(5)18-21-37(49)48-35(36(54-8)24-38(48)50)23-30-25-43-32-17-13-12-16-31(30)32;3-2(4,5)1(6)7/h9-18,21,24-28,33-35,39,43H,19-20,22-23H2,1-8H3,(H,44,51)(H,45,52)(H,46,53);(H,6,7)/b21-18+;/t28-,33-,34-,35-,39-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His-tagged falcipain-3 (33 residues) expressed in Escherichia coli M15 pREP4 using Z-Leu-Arg-AMC as su...				J Med Chem 62: 5562-5578 (2019) Article DOI: 10.1021/acs.jmedchem.9b00504 BindingDB Entry DOI: 10.7270/Q2GQ722K
					More data for this Ligand-Target Pair

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