Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'M1 family aminopeptidase' and Ligand = 'BDBM50206545'   

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
M1 family aminopeptidase (Plasmodium falciparum (isolate FcB1 / Columbia))	BDBM50206545 (2-benzyl-3-(3,4-dihydro-1H-isoquinolin-2-yl)-N-hyd...) Show SMILES ONC(=O)C(Cc1ccccc1)C(=O)N1CCc2ccccc2C1 Show InChI InChI=1S/C19H20N2O3/c22-18(20-24)17(12-14-6-2-1-3-7-14)19(23)21-11-10-15-8-4-5-9-16(15)13-21/h1-9,17,24H,10-13H2,(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	253	n/a	n/a	n/a	n/a	n/a	n/a
Inserm Curated by ChEMBL					Assay Description Inhibition of Plasmodium falciparum FcB1 M1 aminopeptidase				J Med Chem 50: 1322-34 (2007) Article DOI: 10.1021/jm061169b BindingDB Entry DOI: 10.7270/Q2M908B3
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