BDBM50347870 CHEMBL1802869

SMILES: Cc1nc[nH]c1C=C1C(=O)Nc2ccc(NC(=O)C#C)cc12

InChI Key: InChIKey=FNJRSYMEJOVUCU-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 = 50347870   

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
Serine/threonine-protein kinase Nek2 (Homo sapiens (Human))	BDBM50347870 (CHEMBL1802869) Show SMILES Cc1nc[nH]c1C=C1C(=O)Nc2ccc(NC(=O)C#C)cc12 |w:6.6| Show InChI InChI=1S/C16H12N4O2/c1-3-15(21)19-10-4-5-13-11(6-10)12(16(22)20-13)7-14-9(2)17-8-18-14/h1,4-8H,2H3,(H,17,18)(H,19,21)(H,20,22)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of human Nek2 in using [gamma-32P] ATP				J Med Chem 54: 4133-46 (2011) Article DOI: 10.1021/jm200222m BindingDB Entry DOI: 10.7270/Q2QC03TX
					More data for this Ligand-Target Pair