Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 417.4 BDBM301579

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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
Mitogen-activated protein kinase kinase kinase 12 (Homo sapiens (Human))	BDBM301579 (US10131675, Example 65) Show SMILES COc1cc(cnc1N)-c1nc(N2CC(F)(F)C2)c2nc3n(CCOC3(C)C)c2n1 Show InChI InChI=1S/C19H21F2N7O2/c1-18(2)17-24-12-15(27-8-19(20,21)9-27)25-14(26-16(12)28(17)4-5-30-18)10-6-11(29-3)13(22)23-7-10/h6-7H,4-5,8-9H2,1-3H3,(H2,22,23)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. US Patent					Assay Description DLK kinase reactions (20 μL) containing 5 nM N-terminally GST-tagged DLK (catalytic domain amino acid 1-520) (Carna Bioscience), 40 nM N-termina...				US Patent US10131675 (2018) BindingDB Entry DOI: 10.7270/Q21G0P92
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