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SMILES: COc1ccc(Nc2cc(n[nH]c2=O)-c2ccncc2)cc1

InChI Key: InChIKey=PWGYOOFZRYVRNQ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50028088   

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
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50028088 (CHEMBL3338893) Show SMILES COc1ccc(Nc2cc(n[nH]c2=O)-c2ccncc2)cc1 Show InChI InChI=1S/C16H14N4O2/c1-22-13-4-2-12(3-5-13)18-15-10-14(19-20-16(15)21)11-6-8-17-9-7-11/h2-10H,1H3,(H,18,19)(H,20,21)	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	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Nantes Curated by ChEMBL					Assay Description Inhibition of p110alpha (unknown origin)				Bioorg Med Chem Lett 24: 5037-40 (2014) Article DOI: 10.1016/j.bmcl.2014.09.017 BindingDB Entry DOI: 10.7270/Q27H1M51
					More data for this Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM50028088 (CHEMBL3338893) Show SMILES COc1ccc(Nc2cc(n[nH]c2=O)-c2ccncc2)cc1 Show InChI InChI=1S/C16H14N4O2/c1-22-13-4-2-12(3-5-13)18-15-10-14(19-20-16(15)21)11-6-8-17-9-7-11/h2-10H,1H3,(H,18,19)(H,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Nantes Curated by ChEMBL					Assay Description Inhibition of DYRK1A (unknown origin)				Bioorg Med Chem Lett 24: 5037-40 (2014) Article DOI: 10.1016/j.bmcl.2014.09.017 BindingDB Entry DOI: 10.7270/Q27H1M51
					More data for this Ligand-Target Pair