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SMILES: Oc1ccccc1\C=N\NC(=O)CN1CCNCC1

InChI Key: InChIKey=DGYSRIMJCCALKS-OQLLNIDSSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 312057   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Caspase-3 (Homo sapiens (Human))	BDBM312057 (US10166229, Example 00027) Show SMILES Oc1ccccc1\C=N\NC(=O)CN1CCNCC1 Show InChI InChI=1S/C13H18N4O2/c18-12-4-2-1-3-11(12)9-15-16-13(19)10-17-7-5-14-6-8-17/h1-4,9,14,18H,5-8,10H2,(H,16,19)/b15-9+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a
The Board of Trustees of the University of Illinois US Patent					Assay Description Procaspase-3 was recombinantly expressed in E. coli with an N-terminal His-6 tag (SEQ ID NO: 29) and purified. Immunoblotting was performed with an a...				US Patent US10166229 (2019) BindingDB Entry DOI: 10.7270/Q24M96M1
					More data for this Ligand-Target Pair