BDBM50114781 CHEMBL3609669

SMILES: [H][C@@]12C[C@@H](CCN1C(=O)c1cccc(NC(=O)Nc3ncccc3C)c21)OC

InChI Key: InChIKey=VZHXSJJDXKRQMN-CJNGLKHVSA-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 = 50114781   

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))	BDBM50114781 (CHEMBL3609669) Show SMILES [H][C@@]12C[C@@H](CCN1C(=O)c1cccc(NC(=O)Nc3ncccc3C)c21)OC |r| Show InChI InChI=1S/C20H22N4O3/c1-12-5-4-9-21-18(12)23-20(26)22-15-7-3-6-14-17(15)16-11-13(27-2)8-10-24(16)19(14)25/h3-7,9,13,16H,8,10-11H2,1-2H3,(H2,21,22,23,26)/t13-,16+/m1/s1	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	>1.00E+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