Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'RAC-alpha serine/threonine-protein kinase' and Ligand = 'BDBM50528425'   

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))	BDBM50528425 (CHEMBL4591854) Show SMILES O[C@H]([C@@H](O)C(O)=O)C(O)=O.Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CNCC[C@H]1c1ccc(cc1)C(F)(F)F |r,wU:26.26,wD:1.0,2.2,31.33,(70.18,-38.02,;70.18,-39.55,;71.5,-40.31,;71.5,-41.84,;72.82,-39.55,;74.14,-40.31,;72.82,-38.02,;68.86,-40.31,;67.54,-39.55,;68.86,-41.84,;53.11,-37.38,;52.78,-38.88,;51.37,-39.51,;51.53,-41.04,;53.04,-41.36,;53.66,-42.77,;53.81,-40.03,;55.34,-39.87,;56.37,-41.02,;57.77,-40.4,;57.62,-38.87,;56.12,-38.54,;55.49,-37.13,;59.11,-41.17,;59.1,-42.71,;60.44,-40.41,;61.77,-41.18,;61.77,-42.71,;63.1,-43.49,;64.44,-42.72,;64.44,-41.18,;63.11,-40.41,;63.12,-38.88,;61.78,-38.11,;61.78,-36.56,;63.11,-35.79,;64.45,-36.56,;64.45,-38.11,;63.11,-34.25,;64.44,-33.48,;61.77,-33.49,;63.09,-32.71,)| Show InChI InChI=1S/C21H19Cl2F3N4O2.C4H6O6/c1-30-18(15(22)9-28-30)14-8-17(32-19(14)23)20(31)29-16-10-27-7-6-13(16)11-2-4-12(5-3-11)21(24,25)26;5-1(3(7)8)2(6)4(9)10/h2-5,8-9,13,16,27H,6-7,10H2,1H3,(H,29,31);1-2,5-6H,(H,7,8)(H,9,10)/t13-,16+;1-,2-/m01/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.30	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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