BDBM50335655 2-(4-(azepan-4-ylamino)quinazolin-2-yl)phenol::CHEMBL1650104

SMILES: Oc1ccccc1-c1nc(NC2CCCNCC2)c2ccccc2n1

InChI Key: InChIKey=YYDBEVSNHMOPCK-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 = 50335655   

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 CHK2 (Homo sapiens (Human))	BDBM50335655 (2-(4-(azepan-4-ylamino)quinazolin-2-yl)phenol | CH...) Show SMILES Oc1ccccc1-c1nc(NC2CCCNCC2)c2ccccc2n1 Show InChI InChI=1S/C20H22N4O/c25-18-10-4-2-8-16(18)20-23-17-9-3-1-7-15(17)19(24-20)22-14-6-5-12-21-13-11-14/h1-4,7-10,14,21,25H,5-6,11-13H2,(H,22,23,24)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Cancer Research Curated by ChEMBL					Assay Description Inhibition of CHK2 by DELFIA assay				J Med Chem 54: 580-90 (2011) Article DOI: 10.1021/jm101150b BindingDB Entry DOI: 10.7270/Q2DF6RHX
					More data for this Ligand-Target Pair