BDBM50335653 (S)-2-(4-(methyl(pyrrolidin-3-yl)amino)quinazolin-2-yl)phenol::CHEMBL1650102

SMILES: CN([C@H]1CCNC1)c1nc(nc2ccccc12)-c1ccccc1O

InChI Key: InChIKey=AYYIXQFHFFXIFY-ZDUSSCGKSA-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 = 50335653   

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))	BDBM50335653 ((S)-2-(4-(methyl(pyrrolidin-3-yl)amino)quinazolin-...) Show SMILES CN([C@H]1CCNC1)c1nc(nc2ccccc12)-c1ccccc1O |r| Show InChI InChI=1S/C19H20N4O/c1-23(13-10-11-20-12-13)19-14-6-2-4-8-16(14)21-18(22-19)15-7-3-5-9-17(15)24/h2-9,13,20,24H,10-12H2,1H3/t13-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	500	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