Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Microtubule-associated serine/threonine-protein kinase 3' and Ligand = 'BDBM50439430'   

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
Microtubule-associated serine/threonine-protein kinase 3 (Homo sapiens (Human))	BDBM50439430 (CHEMBL2420556) Show SMILES C[C@@H](NC(=O)c1ccc2nc(N[C@H]3CC[C@H](O)CC3)c3nccn3c2c1)c1ccccc1 |r,wU:15.15,wD:12.11,1.0,(21.6,-19.5,;21.6,-21.04,;20.26,-21.81,;18.93,-21.04,;18.93,-19.5,;17.59,-21.81,;17.59,-23.35,;16.26,-24.12,;14.93,-23.35,;13.59,-24.12,;12.26,-23.35,;10.93,-24.12,;9.59,-23.35,;9.59,-21.81,;8.26,-21.04,;6.93,-21.81,;5.59,-21.04,;6.93,-23.35,;8.26,-24.12,;12.26,-21.81,;11.12,-20.78,;11.74,-19.38,;13.27,-19.54,;13.59,-21.04,;14.93,-21.81,;16.26,-21.04,;22.93,-21.81,;22.93,-23.35,;24.26,-24.12,;25.6,-23.35,;25.6,-21.81,;24.26,-21.04,)| Show InChI InChI=1S/C25H27N5O2/c1-16(17-5-3-2-4-6-17)27-25(32)18-7-12-21-22(15-18)30-14-13-26-24(30)23(29-21)28-19-8-10-20(31)11-9-19/h2-7,12-16,19-20,31H,8-11H2,1H3,(H,27,32)(H,28,29)/t16-,19-,20-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a	n/a	n/a
ActivX Biosciences, Inc. Curated by ChEMBL					Assay Description Inhibition of MAST3 in human HuH7 cell lysates				Bioorg Med Chem Lett 23: 5217-22 (2013) Article DOI: 10.1016/j.bmcl.2013.06.087 BindingDB Entry DOI: 10.7270/Q24T6KSR
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