Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prolyl endopeptidase' and Ligand = 'BDBM50051543'   

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
Prolyl endopeptidase (Rattus norvegicus)	BDBM50051543 ((2-Benzyl-cyclopropyl)-[(S)-3-(pyrrolidine-1-carbo...) Show SMILES O=C([C@@H]1C2CCC(CC2)N1C(=O)C1CC1Cc1ccccc1)N1CCCC1 |wU:2.1,(13.05,-9.15,;11.72,-8.36,;10.39,-9.13,;9.06,-8.35,;7.73,-9.13,;7.73,-10.67,;9.06,-11.43,;9.76,-9.27,;8.28,-9.68,;10.39,-10.67,;11.72,-11.44,;13.05,-10.67,;11.72,-12.98,;10.95,-14.33,;12.49,-14.31,;13.82,-15.08,;13.81,-16.62,;15.13,-17.39,;15.12,-18.93,;13.77,-19.7,;12.44,-18.91,;12.47,-17.37,;11.74,-6.82,;12.98,-5.93,;12.49,-4.44,;10.97,-4.46,;10.5,-5.91,)| Show InChI InChI=1S/C23H30N2O2/c26-22(20-15-18(20)14-16-6-2-1-3-7-16)25-19-10-8-17(9-11-19)21(25)23(27)24-12-4-5-13-24/h1-3,6-7,17-21H,4-5,8-15H2/t17?,18?,19?,20?,21-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20	n/a	n/a	n/a	n/a	n/a	n/a
Institut de Recherche Servier Curated by ChEMBL					Assay Description Inhibitory activity of the compound was evaluated against Post-proline cleaving enzyme from rat cortex				J Med Chem 39: 2379-91 (1996) Article DOI: 10.1021/jm950858c BindingDB Entry DOI: 10.7270/Q2RF5T4J
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