Found 2 hits in this display 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 |
Plasmepsin II
(Plasmodium falciparum) | BDBM50200021
((3S,4S)-4-((2S,3S)-2-(4-(4-((S)-(1-(4-(6-methoxyqu...)Show SMILES CCCCNC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccc(Oc2ccc(cc2)C(=O)N[C@@H](CC(C)C)C(=O)NCCCC(C)Nc2cc(OC)cc3cccnc23)cc1)C(C)CC |r| Show InChI InChI=1S/C53H75N7O8/c1-10-12-25-54-47(62)32-46(61)43(28-33(3)4)58-53(66)48(35(7)11-2)60-51(64)38-19-23-41(24-20-38)68-40-21-17-37(18-22-40)50(63)59-45(29-34(5)6)52(65)56-27-13-15-36(8)57-44-31-42(67-9)30-39-16-14-26-55-49(39)44/h14,16-24,26,30-31,33-36,43,45-46,48,57,61H,10-13,15,25,27-29,32H2,1-9H3,(H,54,62)(H,56,65)(H,58,66)(H,59,63)(H,60,64)/t35?,36?,43-,45-,46-,48-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Milan
Curated by ChEMBL
| Assay Description Inhibition of Plasmodium falciparum recombinant PLM2 |
J Med Chem 49: 7440-9 (2006)
Article DOI: 10.1021/jm061033d BindingDB Entry DOI: 10.7270/Q29P319W |
More data for this Ligand-Target Pair | |
Plasmepsin I
(Plasmodium falciparum) | BDBM50200021
((3S,4S)-4-((2S,3S)-2-(4-(4-((S)-(1-(4-(6-methoxyqu...)Show SMILES CCCCNC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)c1ccc(Oc2ccc(cc2)C(=O)N[C@@H](CC(C)C)C(=O)NCCCC(C)Nc2cc(OC)cc3cccnc23)cc1)C(C)CC |r| Show InChI InChI=1S/C53H75N7O8/c1-10-12-25-54-47(62)32-46(61)43(28-33(3)4)58-53(66)48(35(7)11-2)60-51(64)38-19-23-41(24-20-38)68-40-21-17-37(18-22-40)50(63)59-45(29-34(5)6)52(65)56-27-13-15-36(8)57-44-31-42(67-9)30-39-16-14-26-55-49(39)44/h14,16-24,26,30-31,33-36,43,45-46,48,57,61H,10-13,15,25,27-29,32H2,1-9H3,(H,54,62)(H,56,65)(H,58,66)(H,59,63)(H,60,64)/t35?,36?,43-,45-,46-,48-/m0/s1 | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 765 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Milan
Curated by ChEMBL
| Assay Description Inhibition of Plasmodium falciparum recombinant PLM1 |
J Med Chem 49: 7440-9 (2006)
Article DOI: 10.1021/jm061033d BindingDB Entry DOI: 10.7270/Q29P319W |
More data for this Ligand-Target Pair | |