BDBM50243178 (S)-methyl 4-(3-(benzyloxycarbonyl)-2-oxopyridin-1(2H)-yl)-6-phenylhex-2-enoate::CHEMBL487275
SMILES: COC(=O)\C=C\[C@H](CCc1ccccc1)n1cccc(NC(=O)OCc2ccccc2)c1=O
InChI Key: InChIKey=ZUABTEFINXPYNQ-QWYDYZLZSA-N
Data: 2 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Falcipain-2 (Plasmodium falciparum) | BDBM50243178 ((S)-methyl 4-(3-(benzyloxycarbonyl)-2-oxopyridin-1...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Algarve Curated by ChEMBL | Assay Description Inhibition of Plasmodium falciparum recombinant falcipain 2 | Bioorg Med Chem Lett 18: 4210-4 (2008) Article DOI: 10.1016/j.bmcl.2008.05.068 BindingDB Entry DOI: 10.7270/Q27H1JDB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cysteine protease falcipain-3 (Plasmodium falciparum) | BDBM50243178 ((S)-methyl 4-(3-(benzyloxycarbonyl)-2-oxopyridin-1...) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL 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 |
University of Algarve Curated by ChEMBL | Assay Description Inhibition of Plasmodium falciparum recombinant falcipain 3 | Bioorg Med Chem Lett 18: 4210-4 (2008) Article DOI: 10.1016/j.bmcl.2008.05.068 BindingDB Entry DOI: 10.7270/Q27H1JDB | |||||||||||
More data for this Ligand-Target Pair |