Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'RAC-alpha serine/threonine-protein kinase' and Ligand = 'BDBM108442'   

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
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM108442 (US8609688, 20) Show SMILES Nc1ncccc1-c1nc2ccc(Nc3ccc(cc3)N3CCOCC3)nc2n1-c1ccc(cc1)C1(N)CCC1 Show InChI InChI=1S/C31H32N8O/c32-28-25(3-1-16-34-28)29-36-26-12-13-27(35-22-6-10-23(11-7-22)38-17-19-40-20-18-38)37-30(26)39(29)24-8-4-21(5-9-24)31(33)14-2-15-31/h1,3-13,16H,2,14-15,17-20,33H2,(H2,32,34)(H,35,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.72	n/a	n/a	n/a	n/a	8.0	25
ArQule, Inc. US Patent					Assay Description AKT1 activity was assayed using the GSK3-derived biotinylated peptide substrate, crosstide (biotin-GRPRTSSFAEG), and AlphaScreen™ (Amplified Lum...				US Patent US8609688 (2013) BindingDB Entry DOI: 10.7270/Q2H41Q2M
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM108442 (US8609688, 20) Show SMILES Nc1ncccc1-c1nc2ccc(Nc3ccc(cc3)N3CCOCC3)nc2n1-c1ccc(cc1)C1(N)CCC1 Show InChI InChI=1S/C31H32N8O/c32-28-25(3-1-16-34-28)29-36-26-12-13-27(35-22-6-10-23(11-7-22)38-17-19-40-20-18-38)37-30(26)39(29)24-8-4-21(5-9-24)31(33)14-2-15-31/h1,3-13,16H,2,14-15,17-20,33H2,(H2,32,34)(H,35,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.72	n/a	n/a	n/a	n/a	n/a	n/a
ArQule, Inc. US Patent					Assay Description AKT1 activity was assayed using the GSK3-derived biotinylated peptide substrate, crosstide (biotin-GRPRTSSFAEG), and AlphaScreen (Amplified Luminesce...				US Patent US8962619 (2015) BindingDB Entry DOI: 10.7270/Q2W957W7
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM108442 (US8609688, 20) Show SMILES Nc1ncccc1-c1nc2ccc(Nc3ccc(cc3)N3CCOCC3)nc2n1-c1ccc(cc1)C1(N)CCC1 Show InChI InChI=1S/C31H32N8O/c32-28-25(3-1-16-34-28)29-36-26-12-13-27(35-22-6-10-23(11-7-22)38-17-19-40-20-18-38)37-30(26)39(29)24-8-4-21(5-9-24)31(33)14-2-15-31/h1,3-13,16H,2,14-15,17-20,33H2,(H2,32,34)(H,35,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	n/a	57.3	n/a	n/a	n/a	n/a	n/a
ArQule, Inc. US Patent					Assay Description Binding analysis. Protein-ligand binding was identified with the thermal shift assay which is based on the ligand-induced stabilization of the protei...				US Patent US8962619 (2015) BindingDB Entry DOI: 10.7270/Q2W957W7
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM108442 (US8609688, 20) Show SMILES Nc1ncccc1-c1nc2ccc(Nc3ccc(cc3)N3CCOCC3)nc2n1-c1ccc(cc1)C1(N)CCC1 Show InChI InChI=1S/C31H32N8O/c32-28-25(3-1-16-34-28)29-36-26-12-13-27(35-22-6-10-23(11-7-22)38-17-19-40-20-18-38)37-30(26)39(29)24-8-4-21(5-9-24)31(33)14-2-15-31/h1,3-13,16H,2,14-15,17-20,33H2,(H2,32,34)(H,35,37)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	n/a	57.3	n/a	n/a	n/a	7.5	80
ArQule, Inc. US Patent					Assay Description AKT1 activity was assayed using the GSK3-derived biotinylated peptide substrate, crosstide (biotin-GRPRTSSFAEG), and AlphaScreen™ (Amplified Lum...				US Patent US8609688 (2013) BindingDB Entry DOI: 10.7270/Q2H41Q2M
					More data for this Ligand-Target Pair