Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cysteine protease ATG4B' and Ligand = 'BDBM84417'   

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
Cysteine protease ATG4B (Homo sapiens (Human))	BDBM84417 (2-[(3,5-dimethylisoxazol-4-yl)methylthio]-3-phenyl...) Show SMILES Cc1noc(C)c1CSc1nc2ccccc2c(=O)n1-c1ccccc1 Show InChI InChI=1S/C20H17N3O2S/c1-13-17(14(2)25-22-13)12-26-20-21-18-11-7-6-10-16(18)19(24)23(20)15-8-4-3-5-9-15/h3-11H,12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q21V5CG8
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