Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Penicillopepsin-1' and Ligand = 'BDBM50113855'   

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
Penicillopepsin-1 (Penicillium janthinellum)	BDBM50113855 (2,2-Difluoro-3,3-dihydroxy-6-methyl-4-{3-methyl-2-...) Show SMILES CNC(=O)C(F)(F)C(O)(O)[C@@H](CC(C)C)NC(=O)C(NC(=O)C(NC(=O)CC(C)C)C(C)C)C(C)C Show InChI InChI=1S/C24H44F2N4O6/c1-12(2)10-16(24(35,36)23(25,26)22(34)27-9)28-20(32)19(15(7)8)30-21(33)18(14(5)6)29-17(31)11-13(3)4/h12-16,18-19,35-36H,10-11H2,1-9H3,(H,27,34)(H,28,32)(H,29,31)(H,30,33)/t16-,18?,19?/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Parma Curated by ChEMBL					Assay Description Binding affinity against penicillopepsin				J Med Chem 45: 2469-83 (2002) BindingDB Entry DOI: 10.7270/Q28916J7
					More data for this Ligand-Target Pair