Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Caspase-7' and Ligand = 'BDBM50257356'   

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
Caspase-7 (Homo sapiens (Human))	BDBM50257356 ((S)-1-(3-Fluorobutyl)-5-[1-(2-methoxymethylpyrroli...) Show SMILES COC[C@@H]1CCCN1S(=O)(=O)c1ccc2N(CCC(C)F)C(=O)C(=O)c2c1 |r| Show InChI InChI=1S/C18H23FN2O5S/c1-12(19)7-9-20-16-6-5-14(10-15(16)17(22)18(20)23)27(24,25)21-8-3-4-13(21)11-26-2/h5-6,10,12-13H,3-4,7-9,11H2,1-2H3/t12?,13-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.80	n/a	n/a	n/a	n/a	n/a	n/a
Westfälische Wilhelms-Universität Curated by ChEMBL					Assay Description Inhibition of human recombinant caspase 7				Bioorg Med Chem 17: 2680-8 (2009) Article DOI: 10.1016/j.bmc.2009.02.048 BindingDB Entry DOI: 10.7270/Q25Q4W0P
					More data for this Ligand-Target Pair