Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'RAC-alpha serine/threonine-protein kinase' and Ligand = 'BDBM50528479'   

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))	BDBM50528479 (CHEMBL4450403) Show SMILES Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCN2CCOCC2)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:29.33,(61.2,-37.04,;60.88,-38.54,;59.47,-39.16,;59.63,-40.7,;61.13,-41.02,;61.76,-42.43,;61.91,-39.69,;63.44,-39.53,;64.47,-40.68,;65.88,-40.05,;65.72,-38.52,;64.22,-38.2,;63.59,-36.79,;67.22,-40.83,;67.21,-42.37,;68.55,-40.06,;69.88,-40.83,;69.88,-42.37,;71.21,-43.14,;72.55,-42.38,;73.88,-43.15,;75.21,-42.39,;76.54,-43.16,;76.53,-44.7,;77.85,-45.47,;79.19,-44.72,;79.2,-43.17,;77.87,-42.39,;72.55,-40.83,;71.22,-40.07,;71.22,-38.54,;69.89,-37.77,;69.89,-36.22,;71.22,-35.45,;71.21,-33.91,;72.55,-36.21,;73.88,-35.44,;72.56,-37.76,)| Show InChI InChI=1S/C26H29Cl4N5O3/c1-34-24(21(29)13-32-34)18-12-23(38-25(18)30)26(36)33-22-14-31-16(4-5-35-6-8-37-9-7-35)11-17(22)15-2-3-19(27)20(28)10-15/h2-3,10,12-13,16-17,22,31H,4-9,11,14H2,1H3,(H,33,36)/t16-,17+,22-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.80	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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