Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'RAC-alpha serine/threonine-protein kinase' and Ligand = 'BDBM50528453'   

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))	BDBM50528453 (CHEMBL4554683) Show SMILES Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(Cl)cc1 |r,wU:16.17,wD:21.24,(47.52,-7.99,;47.2,-9.5,;45.79,-10.12,;45.95,-11.65,;47.45,-11.98,;48.07,-13.38,;48.22,-10.64,;49.76,-10.49,;50.79,-11.64,;52.19,-11.02,;52.04,-9.48,;50.53,-9.16,;49.91,-7.75,;53.52,-11.79,;53.52,-13.33,;54.86,-11.02,;56.19,-11.8,;56.18,-13.33,;57.51,-14.11,;58.85,-13.34,;58.86,-11.79,;57.52,-11.03,;57.53,-9.49,;56.2,-8.72,;56.2,-7.18,;57.53,-6.41,;57.52,-4.87,;58.86,-7.17,;58.87,-8.72,)| Show InChI InChI=1S/C20H19Cl3N4O2/c1-27-18(15(22)9-25-27)14-8-17(29-19(14)23)20(28)26-16-10-24-7-6-13(16)11-2-4-12(21)5-3-11/h2-5,8-9,13,16,24H,6-7,10H2,1H3,(H,26,28)/t13-,16+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of human Akt1 expressed in Escherichia coli using STK Substrate 2-biotin as substrate incubated for 1 hr by HTRF assay				J Med Chem 62: 7264-7288 (2019) Article DOI: 10.1021/acs.jmedchem.9b00891 BindingDB Entry DOI: 10.7270/Q2XW4P7W
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