Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S]' and Ligand = 'BDBM624780'   

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))	BDBM624780 (US11780851, Example 50) Show SMILES CO[C@H]1CC[C@@H](CC1)n1nc2OCCCn3nc(Cl)c4cnc(Nc2c1Br)nc34 |r,wU:2.1,wD:5.8,(-24.77,11.95,;-24.24,10.5,;-22.7,10.5,;-21.93,11.84,;-20.39,11.84,;-19.62,10.5,;-20.39,9.17,;-21.93,9.17,;-18.08,10.5,;-17.17,9.26,;-15.71,9.73,;-14.94,8.4,;-14.94,6.86,;-13.12,5.83,;-11.78,6.6,;-11.01,7.93,;-9.47,7.93,;-9,9.39,;-7.53,9.87,;-10.24,10.3,;-10.4,11.83,;-11.81,12.46,;-13.06,11.55,;-14.46,12.18,;-15.71,11.27,;-17.17,11.75,;-17.65,13.21,;-12.9,10.02,;-11.49,9.39,)| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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