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SMILES: Cc1nc(-c2sccc2NC(=O)Cc2cccc3ccccc23)n(C)n1

InChI Key: InChIKey=GMDHUVZYMRKGIE-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50332074   

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
Mitogen-activated protein kinase 8 (Homo sapiens (Human))	BDBM50332074 (CHEMBL1287975 | N-(2-(1,3-dimethyl-1H-1,2,4-triazo...) Show SMILES Cc1nc(-c2sccc2NC(=O)Cc2cccc3ccccc23)n(C)n1 Show InChI InChI=1S/C20H18N4OS/c1-13-21-20(24(2)23-13)19-17(10-11-26-19)22-18(25)12-15-8-5-7-14-6-3-4-9-16(14)15/h3-11H,12H2,1-2H3,(H,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant JNK1 after 60 mins by TR-FRET assay				Bioorg Med Chem Lett 20: 7303-7 (2010) Article DOI: 10.1016/j.bmcl.2010.10.066 BindingDB Entry DOI: 10.7270/Q20865JW
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 9 (Homo sapiens (Human))	BDBM50332074 (CHEMBL1287975 | N-(2-(1,3-dimethyl-1H-1,2,4-triazo...) Show SMILES Cc1nc(-c2sccc2NC(=O)Cc2cccc3ccccc23)n(C)n1 Show InChI InChI=1S/C20H18N4OS/c1-13-21-20(24(2)23-13)19-17(10-11-26-19)22-18(25)12-15-8-5-7-14-6-3-4-9-16(14)15/h3-11H,12H2,1-2H3,(H,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant JNK2 after 60 mins by TR-FRET assay				Bioorg Med Chem Lett 20: 7303-7 (2010) Article DOI: 10.1016/j.bmcl.2010.10.066 BindingDB Entry DOI: 10.7270/Q20865JW
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 8 (Homo sapiens (Human))	BDBM50332074 (CHEMBL1287975 | N-(2-(1,3-dimethyl-1H-1,2,4-triazo...) Show SMILES Cc1nc(-c2sccc2NC(=O)Cc2cccc3ccccc23)n(C)n1 Show InChI InChI=1S/C20H18N4OS/c1-13-21-20(24(2)23-13)19-17(10-11-26-19)22-18(25)12-15-8-5-7-14-6-3-4-9-16(14)15/h3-11H,12H2,1-2H3,(H,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
IMAGO PHARMACEUTICALS, INC. US Patent					Assay Description (1) Assay buffer #1 with 0.0025% Tween and 1 mM DTT was prepared using JNK buffer stock solution.(2) Assay buffer #2 with 0.025% BSA was prepared usi...				US Patent US9796706 (2017) BindingDB Entry DOI: 10.7270/Q24T6MHK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 10 (Homo sapiens (Human))	BDBM50332074 (CHEMBL1287975 | N-(2-(1,3-dimethyl-1H-1,2,4-triazo...) Show SMILES Cc1nc(-c2sccc2NC(=O)Cc2cccc3ccccc23)n(C)n1 Show InChI InChI=1S/C20H18N4OS/c1-13-21-20(24(2)23-13)19-17(10-11-26-19)22-18(25)12-15-8-5-7-14-6-3-4-9-16(14)15/h3-11H,12H2,1-2H3,(H,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
IMAGO PHARMACEUTICALS, INC. US Patent					Assay Description (1) Assay buffer #1 with 0.0025% Tween and 1 mM DTT was prepared using JNK buffer stock solution.(2) Assay buffer #2 with 0.025% BSA was prepared usi...				US Patent US9796706 (2017) BindingDB Entry DOI: 10.7270/Q24T6MHK
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 10 (Homo sapiens (Human))	BDBM50332074 (CHEMBL1287975 | N-(2-(1,3-dimethyl-1H-1,2,4-triazo...) Show SMILES Cc1nc(-c2sccc2NC(=O)Cc2cccc3ccccc23)n(C)n1 Show InChI InChI=1S/C20H18N4OS/c1-13-21-20(24(2)23-13)19-17(10-11-26-19)22-18(25)12-15-8-5-7-14-6-3-4-9-16(14)15/h3-11H,12H2,1-2H3,(H,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.15E+4	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant JNK3 after 60 mins by TR-FRET assay				Bioorg Med Chem Lett 20: 7303-7 (2010) Article DOI: 10.1016/j.bmcl.2010.10.066 BindingDB Entry DOI: 10.7270/Q20865JW
					More data for this Ligand-Target Pair