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SMILES: Cn1nc(cc1Nc1ncc(c(NC2CC2)n1)C(F)(F)F)C(C)(C)n1nccn1

InChI Key: InChIKey=ABMDNYHZQQZUCV-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 384382   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM384382 (US10590114, No. 71 | US11111235, No. 69 | US993232...) Show SMILES Cn1nc(cc1Nc1ncc(c(NC2CC2)n1)C(F)(F)F)C(C)(C)n1nccn1 Show InChI InChI=1S/C17H20F3N9/c1-16(2,29-22-6-7-23-29)12-8-13(28(3)27-12)25-15-21-9-11(17(18,19)20)14(26-15)24-10-4-5-10/h6-10H,4-5H2,1-3H3,(H2,21,24,25,26)	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
Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S] (Homo sapiens (Human))	BDBM384382 (US10590114, No. 71 | US11111235, No. 69 | US993232...) Show SMILES Cn1nc(cc1Nc1ncc(c(NC2CC2)n1)C(F)(F)F)C(C)(C)n1nccn1 Show InChI InChI=1S/C17H20F3N9/c1-16(2,29-22-6-7-23-29)12-8-13(28(3)27-12)25-15-21-9-11(17(18,19)20)14(26-15)24-10-4-5-10/h6-10H,4-5H2,1-3H3,(H2,21,24,25,26)	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
Leucine-rich repeat serine/threonine-protein kinase 2 (Homo sapiens (Human))	BDBM384382 (US10590114, No. 71 | US11111235, No. 69 | US993232...) Show SMILES Cn1nc(cc1Nc1ncc(c(NC2CC2)n1)C(F)(F)F)C(C)(C)n1nccn1 Show InChI InChI=1S/C17H20F3N9/c1-16(2,29-22-6-7-23-29)12-8-13(28(3)27-12)25-15-21-9-11(17(18,19)20)14(26-15)24-10-4-5-10/h6-10H,4-5H2,1-3H3,(H2,21,24,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia 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
Denali Therapautics Inc. US Patent					Assay Description Materials: LRRK2 G2019S enzyme Substrate (LRRKtide) ATP TR-FRET dilution buffer pLRRKtide antibody 384-well...				US Patent US10590114 (2020)
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S] (Homo sapiens (Human))	BDBM384382 (US10590114, No. 71 | US11111235, No. 69 | US993232...) Show SMILES Cn1nc(cc1Nc1ncc(c(NC2CC2)n1)C(F)(F)F)C(C)(C)n1nccn1 Show InChI InChI=1S/C17H20F3N9/c1-16(2,29-22-6-7-23-29)12-8-13(28(3)27-12)25-15-21-9-11(17(18,19)20)14(26-15)24-10-4-5-10/h6-10H,4-5H2,1-3H3,(H2,21,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2.23	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (Homo sapiens (Human))	BDBM384382 (US10590114, No. 71 | US11111235, No. 69 | US993232...) Show SMILES Cn1nc(cc1Nc1ncc(c(NC2CC2)n1)C(F)(F)F)C(C)(C)n1nccn1 Show InChI InChI=1S/C17H20F3N9/c1-16(2,29-22-6-7-23-29)12-8-13(28(3)27-12)25-15-21-9-11(17(18,19)20)14(26-15)24-10-4-5-10/h6-10H,4-5H2,1-3H3,(H2,21,24,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia 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
Denali Therapautics Inc. US Patent					Assay Description Materials: LRRK2 G2019S enzyme Substrate (LRRKtide) ATP TR-FRET dilution buffer pLRRKtide antibody 384-well...				US Patent US10590114 (2020)
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S] (Homo sapiens (Human))	BDBM384382 (US10590114, No. 71 | US11111235, No. 69 | US993232...) Show SMILES Cn1nc(cc1Nc1ncc(c(NC2CC2)n1)C(F)(F)F)C(C)(C)n1nccn1 Show InChI InChI=1S/C17H20F3N9/c1-16(2,29-22-6-7-23-29)12-8-13(28(3)27-12)25-15-21-9-11(17(18,19)20)14(26-15)24-10-4-5-10/h6-10H,4-5H2,1-3H3,(H2,21,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 [G2019S] (Homo sapiens (Human))	BDBM384382 (US10590114, No. 71 | US11111235, No. 69 | US993232...) Show SMILES Cn1nc(cc1Nc1ncc(c(NC2CC2)n1)C(F)(F)F)C(C)(C)n1nccn1 Show InChI InChI=1S/C17H20F3N9/c1-16(2,29-22-6-7-23-29)12-8-13(28(3)27-12)25-15-21-9-11(17(18,19)20)14(26-15)24-10-4-5-10/h6-10H,4-5H2,1-3H3,(H2,21,24,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	<30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2 (Homo sapiens (Human))	BDBM384382 (US10590114, No. 71 | US11111235, No. 69 | US993232...) Show SMILES Cn1nc(cc1Nc1ncc(c(NC2CC2)n1)C(F)(F)F)C(C)(C)n1nccn1 Show InChI InChI=1S/C17H20F3N9/c1-16(2,29-22-6-7-23-29)12-8-13(28(3)27-12)25-15-21-9-11(17(18,19)20)14(26-15)24-10-4-5-10/h6-10H,4-5H2,1-3H3,(H2,21,24,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia 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
Denali Therapautics Inc. US Patent					Assay Description Materials: LRRK2 G2019S enzyme Substrate (LRRKtide) ATP TR-FRET dilution buffer pLRRKtide antibody 384-well...				US Patent US10590114 (2020)
					More data for this Ligand-Target Pair