Compile Data Set for Download or QSAR

Found 36 hits Enz. Inhib. hit(s) with all data for entry = 50007833   

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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	29	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	31	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	33	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	57	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	59	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	60	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	68	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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)	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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	84	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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)	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)	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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	156	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	169	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	235	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	270	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	455	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	464	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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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)	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)	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)	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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.10E+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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (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 UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.52E+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 His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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)	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)	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
Cysteine proteinase falcipain 3 (Plasmodium falciparum)	BDBM50513169 (CHEMBL4555310) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\C(C)(C)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/C39H58N6O6.C2HF3O2/c1-23(2)18-29(42-38(50)35(25(5)6)44(9)10)36(48)41-30(19-24(3)4)37(49)43-39(7,8)17-16-33(46)45-31(32(51-11)21-34(45)47)20-26-22-40-28-15-13-12-14-27(26)28;3-2(4,5)1(6)7/h12-17,21-25,29-31,35,40H,18-20H2,1-11H3,(H,41,48)(H,42,50)(H,43,49);(H,6,7)/b17-16+;/t29-,30-,31-,35-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of 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)	BDBM50513171 (CHEMBL4562998) 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(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/C36H52N6O6.C2HF3O2/c1-21(2)17-27(39-34(46)32(22(3)4)41(8)9)33(45)40-36(6,7)35(47)38-23(5)15-16-30(43)42-28(29(48-10)19-31(42)44)18-24-20-37-26-14-12-11-13-25(24)26;3-2(4,5)1(6)7/h11-16,19-23,27-28,32,37H,17-18H2,1-10H3,(H,38,47)(H,39,46)(H,40,45);(H,6,7)/b16-15+;/t23-,27-,28-,32-;/m0./s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of 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
Falcipain 2 (Plasmodium falciparum)	BDBM50513171 (CHEMBL4562998) 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(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/C36H52N6O6.C2HF3O2/c1-21(2)17-27(39-34(46)32(22(3)4)41(8)9)33(45)40-36(6,7)35(47)38-23(5)15-16-30(43)42-28(29(48-10)19-31(42)44)18-24-20-37-26-14-12-11-13-25(24)26;3-2(4,5)1(6)7/h11-16,19-23,27-28,32,37H,17-18H2,1-10H3,(H,38,47)(H,39,46)(H,40,45);(H,6,7)/b16-15+;/t23-,27-,28-,32-;/m0./s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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
Falcipain 2 (Plasmodium falciparum)	BDBM50513169 (CHEMBL4555310) Show SMILES OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\C(C)(C)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/C39H58N6O6.C2HF3O2/c1-23(2)18-29(42-38(50)35(25(5)6)44(9)10)36(48)41-30(19-24(3)4)37(49)43-39(7,8)17-16-33(46)45-31(32(51-11)21-34(45)47)20-26-22-40-28-15-13-12-14-27(26)28;3-2(4,5)1(6)7/h12-17,21-25,29-31,35,40H,18-20H2,1-11H3,(H,41,48)(H,42,50)(H,43,49);(H,6,7)/b17-16+;/t29-,30-,31-,35-;/m0./s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The University of Sydney Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum N-terminal His6-tagged falcipain-2 (35 residues) expressed in Escherichia coli M15 pREP4 using Z-Lue-Arg-AMC as s...				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