BDBM50114678 CHEMBL3609656

SMILES: O=C(Nc1cnccn1)Nc1cccc2C(=O)N3CCC(=O)CC3c12

InChI Key: InChIKey=NLMVAZXUBGKOGT-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50114678   

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))	BDBM50114678 (CHEMBL3609656) Show SMILES O=C(Nc1cnccn1)Nc1cccc2C(=O)N3CCC(=O)CC3c12 Show InChI InChI=1S/C17H15N5O3/c23-10-4-7-22-13(8-10)15-11(16(22)24)2-1-3-12(15)20-17(25)21-14-9-18-5-6-19-14/h1-3,5-6,9,13H,4,7-8H2,(H2,19,20,21,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
CNRS UMR 7311 Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged DYRK1A expressed in Escherichia coli				Eur J Med Chem 101: 274-87 (2015) BindingDB Entry DOI: 10.7270/Q24T6M53
					More data for this Ligand-Target Pair