Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 244.2 BDBM299556

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

Found 2 hits 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 kinase 4 (Homo sapiens (Human))	BDBM299556 (6-[(3S)-3-amino-1- piperidyl]pyrido [3,2-d]pyrimid...) Show SMILES N[C@H]1CCCN(C1)c1ccc2ncnc(N)c2n1 |r| Show InChI InChI=1S/C12H16N6/c13-8-2-1-5-18(6-8)10-4-3-9-11(17-10)12(14)16-7-15-9/h3-4,7-8H,1-2,5-6,13H2,(H2,14,15,16)/t8-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Frosst Centre for Therapeutic Research					Assay Description The kinase activity of purified human MAP4K4 kinase domain was measured by monitoring the phosphorylation of a peptide substrate derived from moesin ...				J Med Chem 46: 3709-27 (2003) BindingDB Entry DOI: 10.7270/Q2VH5R4B
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase kinase 4 (Homo sapiens (Human))	BDBM299556 (6-[(3S)-3-amino-1- piperidyl]pyrido [3,2-d]pyrimid...) Show SMILES N[C@H]1CCCN(C1)c1ccc2ncnc(N)c2n1 |r| Show InChI InChI=1S/C12H16N6/c13-8-2-1-5-18(6-8)10-4-3-9-11(17-10)12(14)16-7-15-9/h3-4,7-8H,1-2,5-6,13H2,(H2,14,15,16)/t8-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. US Patent					Assay Description The kinase activity of purified human MAP4K4 kinase domain was measured by monitoring the phosphorylation of a peptide substrate derived from moesin ...				US Patent US9592235 (2017) BindingDB Entry DOI: 10.7270/Q2VX0JKX
					More data for this Ligand-Target Pair