Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'RAC-alpha serine/threonine-protein kinase' and Ligand = 'BDBM50528461'   

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))	BDBM50528461 (CHEMBL4517950) Show SMILES Cn1ncc(Cl)c1-c1cc(oc1Cl)C(=O)N[C@@H]1CN[C@H](CCO)C[C@H]1c1ccc(Cl)c(Cl)c1 |r,wU:16.17,19.21,wD:24.27,(72.74,-6.97,;72.42,-8.47,;71.01,-9.1,;71.17,-10.63,;72.67,-10.95,;73.3,-12.36,;73.45,-9.62,;74.98,-9.46,;76.01,-10.61,;77.43,-9.98,;77.26,-8.45,;75.76,-8.13,;75.13,-6.72,;78.76,-10.76,;78.75,-12.3,;80.09,-9.99,;81.42,-10.77,;81.42,-12.3,;82.75,-13.08,;84.09,-12.31,;85.42,-13.08,;86.76,-12.32,;88.09,-13.09,;84.1,-10.76,;82.76,-10,;82.76,-8.47,;81.43,-7.7,;81.43,-6.15,;82.76,-5.38,;82.75,-3.84,;84.09,-6.15,;85.42,-5.37,;84.1,-7.7,)| Show InChI InChI=1S/C22H22Cl4N4O3/c1-30-20(17(25)9-28-30)14-8-19(33-21(14)26)22(32)29-18-10-27-12(4-5-31)7-13(18)11-2-3-15(23)16(24)6-11/h2-3,6,8-9,12-13,18,27,31H,4-5,7,10H2,1H3,(H,29,32)/t12-,13+,18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	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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