BDBM50114786 CHEMBL3609675

SMILES: [H][C@@]12C[C@@H](CCN1C(=O)c1cccc(NC(=O)Nc3cnc(C)cn3)c21)OC

InChI Key: InChIKey=DEDLKMNQMUPQOI-DOMZBBRYSA-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 = 50114786   

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))	BDBM50114786 (CHEMBL3609675) Show SMILES [H][C@@]12C[C@@H](CCN1C(=O)c1cccc(NC(=O)Nc3cnc(C)cn3)c21)OC |r| Show InChI InChI=1S/C19H21N5O3/c1-11-9-21-16(10-20-11)23-19(26)22-14-5-3-4-13-17(14)15-8-12(27-2)6-7-24(15)18(13)25/h3-5,9-10,12,15H,6-8H2,1-2H3,(H2,21,22,23,26)/t12-,15+/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