Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S]' and Ligand = 'BDBM384307'   

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
Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S] (Homo sapiens (Human))	BDBM384307 (US11591316, Compound 11 | US9932325, Example 11) Show SMILES CNc1nc(Nc2cnn(C3CC4[C@H](C3)C4(F)F)c2C)ncc1C(F)(F)F |r| Show InChI InChI=1S/C16H17F5N6/c1-7-12(6-24-27(7)8-3-9-10(4-8)15(9,17)18)25-14-23-5-11(16(19,20)21)13(22-2)26-14/h5-6,8-10H,3-4H2,1-2H3,(H2,22,23,25,26)/t8?,9-,10?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<30	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Compounds were prepared by initially diluting to 1 mM with DMSO. 35 μL of reference compound solution, 35 μL of test compound solution, and...				Citation and Details BindingDB Entry DOI: 10.7270/Q2SJ1QJH
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S] (Homo sapiens (Human))	BDBM384307 (US11591316, Compound 11 | US9932325, Example 11) Show SMILES CNc1nc(Nc2cnn(C3CC4[C@H](C3)C4(F)F)c2C)ncc1C(F)(F)F |r| Show InChI InChI=1S/C16H17F5N6/c1-7-12(6-24-27(7)8-3-9-10(4-8)15(9,17)18)25-14-23-5-11(16(19,20)21)13(22-2)26-14/h5-6,8-10H,3-4H2,1-2H3,(H2,22,23,25,26)/t8?,9-,10?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<30	n/a	n/a	n/a	n/a	n/a	n/a
Universita degli Studi di Firenze					Assay Description Materials: LRRK2 G2019S enzyme Substrate (LRRKtide) ATP TR-FRET dilution buffer pLRRKtide antibody 384-well...				Bioorg Med Chem Lett 18: 2567-73 (2008) BindingDB Entry DOI: 10.7270/Q29G5Q4M
					More data for this Ligand-Target Pair