Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Leucine-rich repeat serine/threonine-protein kinase 2' and Ligand = 'BDBM50260922'   

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 (Homo sapiens (Human))	BDBM50260922 (CHEMBL4060747) Show SMILES Cc1ccc(cc1)-c1cnc(N)c(c1)-c1nnc(o1)C1CC1 Show InChI InChI=1S/C17H16N4O/c1-10-2-4-11(5-3-10)13-8-14(15(18)19-9-13)17-21-20-16(22-17)12-6-7-12/h2-5,8-9,12H,6-7H2,1H3,(H2,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S, Ottiliavej 9, 2500 Valby, Denmark. Electronic address: gsm@lundbeck.com. Curated by ChEMBL					Assay Description Inhibition of recombinant human LRRK2 (970 to 2527 residues) G2019S mutant expressed in baculovirus preincubated for 30 mins followed by fluorescein-...				Bioorg Med Chem Lett 27: 4500-4505 (2017) Article DOI: 10.1016/j.bmcl.2017.07.072 BindingDB Entry DOI: 10.7270/Q2SF2ZMN
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (Homo sapiens (Human))	BDBM50260922 (CHEMBL4060747) Show SMILES Cc1ccc(cc1)-c1cnc(N)c(c1)-c1nnc(o1)C1CC1 Show InChI InChI=1S/C17H16N4O/c1-10-2-4-11(5-3-10)13-8-14(15(18)19-9-13)17-21-20-16(22-17)12-6-7-12/h2-5,8-9,12H,6-7H2,1H3,(H2,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
H. Lundbeck A/S, Ottiliavej 9, 2500 Valby, Denmark. Electronic address: gsm@lundbeck.com. Curated by ChEMBL					Assay Description Inhibition of recombinant human wild type GST-tagged LRRK2 (970 to 2527 residues) preincubated for 30 mins followed by fluorescein-LRRKtide substrate...				Bioorg Med Chem Lett 27: 4500-4505 (2017) Article DOI: 10.1016/j.bmcl.2017.07.072 BindingDB Entry DOI: 10.7270/Q2SF2ZMN
					More data for this Ligand-Target Pair