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SMILES: COC(=O)c1cccnc1NC(=O)Nc1cccc2C(=O)N3CCCCC3c12

InChI Key: InChIKey=HIXHOBYQJQZEPE-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50161336   

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
Dual specificity tyrosine-phosphorylation-regulated kinase 1A (Homo sapiens (Human))	BDBM50161336 (CHEMBL3786657) Show SMILES COC(=O)c1cccnc1NC(=O)Nc1cccc2C(=O)N3CCCCC3c12 Show InChI InChI=1S/C20H20N4O4/c1-28-19(26)13-7-5-10-21-17(13)23-20(27)22-14-8-4-6-12-16(14)15-9-2-3-11-24(15)18(12)25/h4-8,10,15H,2-3,9,11H2,1H3,(H2,21,22,23,27)	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	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans Curated by ChEMBL					Assay Description Inhibition of GST fused human recombinant DYRK1A expressed in Escherichia coli using woodtide as substrate after 30 mins by scintillation counting in...				Eur J Med Chem 115: 311-25 (2016) Article DOI: 10.1016/j.ejmech.2016.02.072 BindingDB Entry DOI: 10.7270/Q2JM2CHT
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1 (Homo sapiens (Human))	BDBM50161336 (CHEMBL3786657) Show SMILES COC(=O)c1cccnc1NC(=O)Nc1cccc2C(=O)N3CCCCC3c12 Show InChI InChI=1S/C20H20N4O4/c1-28-19(26)13-7-5-10-21-17(13)23-20(27)22-14-8-4-6-12-16(14)15-9-2-3-11-24(15)18(12)25/h4-8,10,15H,2-3,9,11H2,1H3,(H2,21,22,23,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia 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£ d'Orl£ans Curated by ChEMBL					Assay Description Inhibition of human recombinant CDK5/p25 using histone H1 as substrate				Eur J Med Chem 115: 311-25 (2016) Article DOI: 10.1016/j.ejmech.2016.02.072 BindingDB Entry DOI: 10.7270/Q2JM2CHT
					More data for this Ligand-Target Pair