Compile Data Set for Download or QSAR

Found 61 hits with Last Name = 'bhattacharya' and Initial = 'ak'   

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
Cathepsin B (Homo sapiens (Human))	BDBM16510 ((2S,3S)-3-[[(1S)-1-(isoamylcarbamoyl)-3-methyl-but...) Show SMILES CC(C)CCNC(=O)[C@H](CC(C)C)NC(=O)[C@H]1O[C@@H]1C(O)=O |r| Show InChI InChI=1S/C15H26N2O5/c1-8(2)5-6-16-13(18)10(7-9(3)4)17-14(19)11-12(22-11)15(20)21/h8-12H,5-7H2,1-4H3,(H,16,18)(H,17,19)(H,20,21)/t10-,11-,12-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	3.36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Chemical Laboratory (CSIR-NCL) Curated by ChEMBL					Assay Description Inhibition of cathepsin B				Bioorg Med Chem 19: 7129-35 (2011) Article DOI: 10.1016/j.bmc.2011.09.058 BindingDB Entry DOI: 10.7270/Q2KW5GGT
					More data for this Ligand-Target Pair				3D Structure (crystal)
Papain (Carica papaya)	BDBM50364010 (CHEMBL1950263) Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6]=[#7]-[#7]-[#6](-[#7])=O |r,w:39.41| Show InChI InChI=1S/C30H43N9O5/c1-3-20(2)25(27(41)36-23(18-35-39-29(33)42)17-21-11-6-4-7-12-21)38-26(40)24(15-10-16-34-28(31)32)37-30(43)44-19-22-13-8-5-9-14-22/h4-9,11-14,18,20,23-25H,3,10,15-17,19H2,1-2H3,(H,36,41)(H,37,43)(H,38,40)(H4,31,32,34)(H3,33,39,42)/t20-,23-,24-,25-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Chemical Laboratory (CSIR-NCL) Curated by ChEMBL					Assay Description Inhibition of papaya papain				Bioorg Med Chem 19: 7129-35 (2011) Article DOI: 10.1016/j.bmc.2011.09.058 BindingDB Entry DOI: 10.7270/Q2KW5GGT
					More data for this Ligand-Target Pair
Cathepsin B (Homo sapiens (Human))	BDBM50364010 (CHEMBL1950263) Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6]=[#7]-[#7]-[#6](-[#7])=O |r,w:39.41| Show InChI InChI=1S/C30H43N9O5/c1-3-20(2)25(27(41)36-23(18-35-39-29(33)42)17-21-11-6-4-7-12-21)38-26(40)24(15-10-16-34-28(31)32)37-30(43)44-19-22-13-8-5-9-14-22/h4-9,11-14,18,20,23-25H,3,10,15-17,19H2,1-2H3,(H,36,41)(H,37,43)(H,38,40)(H4,31,32,34)(H3,33,39,42)/t20-,23-,24-,25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Chemical Laboratory (CSIR-NCL) Curated by ChEMBL					Assay Description Inhibition of cathepsin B				Bioorg Med Chem 19: 7129-35 (2011) Article DOI: 10.1016/j.bmc.2011.09.058 BindingDB Entry DOI: 10.7270/Q2KW5GGT
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558642 (US11365202, Compound 3a) Show SMILES CCOP(=O)(OCC)\C=C\[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.49E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578419 (CHEMBL4857262) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.49E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578421 (CHEMBL4850572) Show SMILES [H][C@]1(C[C@H](N(C1)C(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)O[C@H]1O[C@]2([H])O[C@@]3(C)CC[C@@]4([H])[C@H](C)CC[C@@]([H])([C@H]1C)[C@@]24OO3 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558644 (US11365202, Compound 5a) Show SMILES CCOP(=O)(OCC)\C=C\[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1C[C@H](CN1C(=O)OCc1ccccc1)O[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)c1ccccc1 |r| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558642 (US11365202, Compound 3a) Show SMILES CCOP(=O)(OCC)\C=C\[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.78E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578417 (CHEMBL4868442) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.78E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578406 (CHEMBL4869807) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)NC(\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.32E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558638 (US11365202, Compound 3) Show SMILES CCOP(=O)(OCC)\C=C\C(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.32E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558637 (US11365202, Compound 2) Show SMILES CCOP(=O)(OCC)\C=C\C(NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.49E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578405 (CHEMBL4856045) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.49E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558640 (US11365202, Compound 5) Show SMILES CCOP(=O)(OCC)\C=C\C(NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1C[C@H](CN1C(=O)OCc1ccccc1)O[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)c1ccccc1 |r| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	4.54E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578408 (CHEMBL4857754) Show SMILES [H][C@]1(C[C@H](N(C1)C(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)NC(\C=C\P(=O)(OCC)OCC)c1ccccc1)O[C@H]1O[C@]2([H])O[C@@]3(C)CC[C@@]4([H])[C@H](C)CC[C@@]([H])([C@H]1C)[C@@]24OO3 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.54E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578420 (CHEMBL4853187) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.91E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558643 (US11365202, Compound 3b) Show SMILES CCOP(=O)(OCC)\C=C\[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	6.91E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558643 (US11365202, Compound 3b) Show SMILES CCOP(=O)(OCC)\C=C\[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	9.92E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578418 (CHEMBL4871791) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	9.92E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558642 (US11365202, Compound 3a) Show SMILES CCOP(=O)(OCC)\C=C\[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578419 (CHEMBL4857262) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578421 (CHEMBL4850572) Show SMILES [H][C@]1(C[C@H](N(C1)C(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)O[C@H]1O[C@]2([H])O[C@@]3(C)CC[C@@]4([H])[C@H](C)CC[C@@]([H])([C@H]1C)[C@@]24OO3 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.53E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558644 (US11365202, Compound 5a) Show SMILES CCOP(=O)(OCC)\C=C\[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1C[C@H](CN1C(=O)OCc1ccccc1)O[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)c1ccccc1 |r| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.53E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578417 (CHEMBL4868442) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.78E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558642 (US11365202, Compound 3a) Show SMILES CCOP(=O)(OCC)\C=C\[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.78E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578406 (CHEMBL4869807) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)NC(\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558638 (US11365202, Compound 3) Show SMILES CCOP(=O)(OCC)\C=C\C(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578405 (CHEMBL4856045) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558637 (US11365202, Compound 2) Show SMILES CCOP(=O)(OCC)\C=C\C(NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578408 (CHEMBL4857754) Show SMILES [H][C@]1(C[C@H](N(C1)C(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)NC(\C=C\P(=O)(OCC)OCC)c1ccccc1)O[C@H]1O[C@]2([H])O[C@@]3(C)CC[C@@]4([H])[C@H](C)CC[C@@]([H])([C@H]1C)[C@@]24OO3 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558640 (US11365202, Compound 5) Show SMILES CCOP(=O)(OCC)\C=C\C(NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1C[C@H](CN1C(=O)OCc1ccccc1)O[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)c1ccccc1 |r| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578420 (CHEMBL4853187) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558643 (US11365202, Compound 3b) Show SMILES CCOP(=O)(OCC)\C=C\[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558645 (US11365202, Compound 5b) Show SMILES CCOP(=O)(OCC)\C=C\[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1C[C@H](CN1C(=O)OCc1ccccc1)O[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)c1ccccc1 |r| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578422 (CHEMBL4845812) Show SMILES [H][C@]1(C[C@H](N(C1)C(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)O[C@H]1O[C@]2([H])O[C@@]3(C)CC[C@@]4([H])[C@H](C)CC[C@@]([H])([C@H]1C)[C@@]24OO3 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD 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
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578418 (CHEMBL4871791) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558643 (US11365202, Compound 3b) Show SMILES CCOP(=O)(OCC)\C=C\[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578410 (CHEMBL4859406) Show SMILES CCOP(=O)(OCC)\C=C\C(N)c1ccccc1 Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50364000 (CHEMBL1950253) Show SMILES CCOP(=O)(CC=C(NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)c1ccccc1)OCC |r,w:6.5| Show InChI InChI=1S/C30H35N2O6P/c1-3-37-39(35,38-4-2)21-20-27(26-18-12-7-13-19-26)31-29(33)28(22-24-14-8-5-9-15-24)32-30(34)36-23-25-16-10-6-11-17-25/h5-20,28H,3-4,21-23H2,1-2H3,(H,31,33)(H,32,34)/t28-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Chemical Laboratory (CSIR-NCL) Curated by ChEMBL					Assay Description Inhibition of papaya papain using BAPNA as substrate assessed as p-nitroaniline release by spectrophotometric analysis				Bioorg Med Chem 19: 7129-35 (2011) Article DOI: 10.1016/j.bmc.2011.09.058 BindingDB Entry DOI: 10.7270/Q2KW5GGT
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50364002 (CHEMBL1950255) Show SMILES CCOP(=O)(CC=C(NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1)OCC |r,w:6.5| Show InChI InChI=1S/C27H37N2O6P/c1-6-33-36(32,34-7-2)19-18-23(22-16-12-9-13-17-22)28-25(30)24(20-21-14-10-8-11-15-21)29-26(31)35-27(3,4)5/h8-18,24H,6-7,19-20H2,1-5H3,(H,28,30)(H,29,31)/t24-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Chemical Laboratory (CSIR-NCL) Curated by ChEMBL					Assay Description Inhibition of papaya papain using BAPNA as substrate assessed as p-nitroaniline release by spectrophotometric analysis				Bioorg Med Chem 19: 7129-35 (2011) Article DOI: 10.1016/j.bmc.2011.09.058 BindingDB Entry DOI: 10.7270/Q2KW5GGT
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50364004 (CHEMBL1950257) Show SMILES CCOP(=O)(CC=C(NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)OCc1ccccc1)c1ccccc1)OCC |r,w:6.5| Show InChI InChI=1S/C30H35N2O7P/c1-3-38-40(36,39-4-2)20-19-27(25-13-9-6-10-14-25)31-29(34)28(21-23-15-17-26(33)18-16-23)32-30(35)37-22-24-11-7-5-8-12-24/h5-19,28,33H,3-4,20-22H2,1-2H3,(H,31,34)(H,32,35)/t28-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Chemical Laboratory (CSIR-NCL) Curated by ChEMBL					Assay Description Inhibition of papaya papain using BAPNA as substrate assessed as p-nitroaniline release by spectrophotometric analysis				Bioorg Med Chem 19: 7129-35 (2011) Article DOI: 10.1016/j.bmc.2011.09.058 BindingDB Entry DOI: 10.7270/Q2KW5GGT
					More data for this Ligand-Target Pair
Papain (Carica papaya)	BDBM50364008 (CHEMBL1950261) Show SMILES CCOP(=O)(CC=C(NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccccc1)OCC |r,w:6.5| Show InChI InChI=1S/C36H46N3O7P/c1-6-44-47(43,45-7-2)24-23-30(29-21-15-10-16-22-29)37-33(40)31(25-27-17-11-8-12-18-27)38-34(41)32(26-28-19-13-9-14-20-28)39-35(42)46-36(3,4)5/h8-23,31-32H,6-7,24-26H2,1-5H3,(H,37,40)(H,38,41)(H,39,42)/t31-,32-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Chemical Laboratory (CSIR-NCL) Curated by ChEMBL					Assay Description Inhibition of papaya papain using BAPNA as substrate assessed as p-nitroaniline release by spectrophotometric analysis				Bioorg Med Chem 19: 7129-35 (2011) Article DOI: 10.1016/j.bmc.2011.09.058 BindingDB Entry DOI: 10.7270/Q2KW5GGT
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578403 (CHEMBL4870974) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)NC(\C=C\P(=O)(OCC)OCC)c1ccccc1)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558639 (US11365202, Compound 4) Show SMILES CCOP(=O)(OCC)\C=C\C(NC(=O)[C@@H]1C[C@H](CN1C(=O)OCc1ccccc1)O[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)c1ccccc1 |r| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558641 (US11365202, Compound 6) Show SMILES CCOP(=O)(OCC)\C=C\C(NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H](CN1C(=O)OCc1ccccc1)O[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)c1ccccc1 |r| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578404 (CHEMBL4864385) Show SMILES [H][C@]1(C[C@H](N(C1)C(=O)OCc1ccccc1)C(=O)NC(\C=C\P(=O)(OCC)OCC)c1ccccc1)O[C@H]1O[C@]2([H])O[C@@]3(C)CC[C@@]4([H])[C@H](C)CC[C@@]([H])([C@H]1C)[C@@]24OO3 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578407 (CHEMBL4861198) Show SMILES [H][C@]1(C[C@H](N(C1)C(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC(\C=C\P(=O)(OCC)OCC)c1ccccc1)O[C@H]1O[C@]2([H])O[C@@]3(C)CC[C@@]4([H])[C@H](C)CC[C@@]([H])([C@H]1C)[C@@]24OO3 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578409 (CHEMBL307261) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@]4(C)OO[C@@]13[C@]([H])(O[C@H](O)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair
Heme ligase (Plasmodium falciparum (isolate 3D7))	BDBM558636 (US11365202, Compound 1) Show SMILES CCOP(=O)(OCC)\C=C\C(NC(=O)[C@H](CO[C@H]1O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3)NC(=O)OCc1ccccc1)c1ccccc1 |r,$;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;N;;;;;;;;;;;;;;;;$| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description TBD				Citation and Details BindingDB Entry DOI: 10.7270/Q2F47SBP
					More data for this Ligand-Target Pair
Cysteine proteinase falcipain 2a (Plasmodium falciparum)	BDBM50578411 (CHEMBL4858403) Show SMILES [H][C@@]12CC[C@@H](C)[C@]3([H])CC[C@@]4(C)OO[C@@]13[C@]([H])(O[C@H](OC[C@H](NC(=O)OCc1ccccc1)C(=O)OC)[C@@H]2C)O4 |r| Show InChI	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant Plasmodium falciparum falcipain-2 expressed in Escherichia coli M15 assessed as reduction in free AMC release using Z-FR-AM...				Citation and Details Article DOI: 10.1016/j.ejmech.2021.113454 BindingDB Entry DOI: 10.7270/Q25T3Q99
					More data for this Ligand-Target Pair

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