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SMILES: CC(C)NC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)(F)F

InChI Key: InChIKey=ORFQXNMTLHYGKN-OAHLLOKOSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 369761   

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
Ribosomal protein S6 kinase beta-1 (Homo sapiens (Human))	BDBM369761 (US10233160, Compound 52 | US9981925, Compound 52) Show SMILES CC(C)NC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)(F)F |r| Show InChI InChI=1S/C20H20F4N6O/c1-10(2)27-8-15(11-3-4-14(21)13(7-11)20(22,23)24)30-19-17-16(28-9-29-19)12(18(25)31)5-6-26-17/h3-7,9-10,15,27H,8H2,1-2H3,(H2,25,31)(H,28,29,30)/t15-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	62	n/a	n/a	n/a	n/a	n/a	n/a
University of Athens					Assay Description p70S6K inhibitor compounds were diluted and plated in 96 well plates. A reaction mixture including the following components were then added to the co...				J Med Chem 51: 2216-2226 (2008) BindingDB Entry DOI: 10.7270/Q27H1MWF
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM369761 (US10233160, Compound 52 | US9981925, Compound 52) Show SMILES CC(C)NC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)(F)F |r| Show InChI InChI=1S/C20H20F4N6O/c1-10(2)27-8-15(11-3-4-14(21)13(7-11)20(22,23)24)30-19-17-16(28-9-29-19)12(18(25)31)5-6-26-17/h3-7,9-10,15,27H,8H2,1-2H3,(H2,25,31)(H,28,29,30)/t15-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	62.5	n/a	n/a	n/a	n/a	n/a	n/a
Anadys Pharmaceuticals					Assay Description In order to measure AKT inhibition in the Caliper Life Sciences LC3000, a TTP Mosquito liquid handling instrument was used to place 125 nl of the app...				Bioorg Med Chem Lett 18: 4181-5 (2008) BindingDB Entry DOI: 10.7270/Q2319Z6K
					More data for this Ligand-Target Pair
Ribosomal protein S6 kinase beta-1 (Homo sapiens (Human))	BDBM369761 (US10233160, Compound 52 | US9981925, Compound 52) Show SMILES CC(C)NC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)(F)F |r| Show InChI InChI=1S/C20H20F4N6O/c1-10(2)27-8-15(11-3-4-14(21)13(7-11)20(22,23)24)30-19-17-16(28-9-29-19)12(18(25)31)5-6-26-17/h3-7,9-10,15,27H,8H2,1-2H3,(H2,25,31)(H,28,29,30)/t15-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<25	n/a	n/a	n/a	n/a	n/a	n/a
Anadys Pharmaceuticals					Assay Description p70S6K inhibitor compounds were diluted and plated in 96 well plates. A reaction mixture including the following components were then added to the co...				Bioorg Med Chem Lett 18: 4181-5 (2008) BindingDB Entry DOI: 10.7270/Q2319Z6K
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM369761 (US10233160, Compound 52 | US9981925, Compound 52) Show SMILES CC(C)NC[C@@H](Nc1ncnc2c(ccnc12)C(N)=O)c1ccc(F)c(c1)C(F)(F)F |r| Show InChI InChI=1S/C20H20F4N6O/c1-10(2)27-8-15(11-3-4-14(21)13(7-11)20(22,23)24)30-19-17-16(28-9-29-19)12(18(25)31)5-6-26-17/h3-7,9-10,15,27H,8H2,1-2H3,(H2,25,31)(H,28,29,30)/t15-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
University of Athens					Assay Description In order to measure AKT inhibition in the Caliper Life Sciences LC3000, a TTP Mosquito liquid handling instrument was used to place 125 nl of the app...				J Med Chem 51: 2216-2226 (2008) BindingDB Entry DOI: 10.7270/Q27H1MWF
					More data for this Ligand-Target Pair