BDBM50243177 (S)-benzyl 2-oxo-1-(1-oxo-4-phenylbutan-2-yl)-1,2-dihydropyridin-3-ylcarbamate::CHEMBL488829

SMILES: O=C[C@H](CCc1ccccc1)n1cccc(NC(=O)OCc2ccccc2)c1=O

InChI Key: InChIKey=IABRWLMQSLYNJA-FQEVSTJZSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50243177   

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)	BDBM50243177 ((S)-benzyl 2-oxo-1-(1-oxo-4-phenylbutan-2-yl)-1,2-...) Show SMILES O=C[C@H](CCc1ccccc1)n1cccc(NC(=O)OCc2ccccc2)c1=O |r| Show InChI InChI=1S/C23H22N2O4/c26-16-20(14-13-18-8-3-1-4-9-18)25-15-7-12-21(22(25)27)24-23(28)29-17-19-10-5-2-6-11-19/h1-12,15-16,20H,13-14,17H2,(H,24,28)/t20-/m0/s1	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.09E+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)	BDBM50243177 ((S)-benzyl 2-oxo-1-(1-oxo-4-phenylbutan-2-yl)-1,2-...) Show SMILES O=C[C@H](CCc1ccccc1)n1cccc(NC(=O)OCc2ccccc2)c1=O |r| Show InChI InChI=1S/C23H22N2O4/c26-16-20(14-13-18-8-3-1-4-9-18)25-15-7-12-21(22(25)27)24-23(28)29-17-19-10-5-2-6-11-19/h1-12,15-16,20H,13-14,17H2,(H,24,28)/t20-/m0/s1	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	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