BDBM50323810 6-Methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-methylpiperidin-4-yl)-7-(3-morpholinopropoxy)quinazolin-4-amine::CHEMBL1213958

SMILES: COc1cc2c(NC3CCN(C)CC3)nc(nc2cc1OCCCN1CCOCC1)N1CCCN(C)CC1

InChI Key: InChIKey=WUGAIKUDKBPNMJ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50323810   

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
Protein G9a (G9a) (Homo sapiens (Human))	BDBM50323810 (6-Methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-meth...) Show SMILES COc1cc2c(NC3CCN(C)CC3)nc(nc2cc1OCCCN1CCOCC1)N1CCCN(C)CC1 Show InChI InChI=1S/C28H45N7O3/c1-32-8-4-10-35(14-13-32)28-30-24-21-26(38-17-5-9-34-15-18-37-19-16-34)25(36-3)20-23(24)27(31-28)29-22-6-11-33(2)12-7-22/h20-22H,4-19H2,1-3H3,(H,29,30,31)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.80E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Chapel Hill Curated by ChEMBL					Assay Description Inhibition of methyl transferase activity of G9a assessed as inhibition of H3K9 methylation by chemiluminescence based oxygen tunneling assay				J Med Chem 53: 5844-57 (2010) Article DOI: 10.1021/jm100478y BindingDB Entry DOI: 10.7270/Q2DZ08H1
					More data for this Ligand-Target Pair
Protein G9a (G9a) (Homo sapiens (Human))	BDBM50323810 (6-Methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-meth...) Show SMILES COc1cc2c(NC3CCN(C)CC3)nc(nc2cc1OCCCN1CCOCC1)N1CCCN(C)CC1 Show InChI InChI=1S/C28H45N7O3/c1-32-8-4-10-35(14-13-32)28-30-24-21-26(38-17-5-9-34-15-18-37-19-16-34)25(36-3)20-23(24)27(31-28)29-22-6-11-33(2)12-7-22/h20-22H,4-19H2,1-3H3,(H,29,30,31)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.80E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of North Carolina at Chapel Hill Curated by ChEMBL					Assay Description Activity at methyl transferase activity G9a by enzyme coupled S-adenocylehomocystein detection assay				J Med Chem 53: 5844-57 (2010) Article DOI: 10.1021/jm100478y BindingDB Entry DOI: 10.7270/Q2DZ08H1
					More data for this Ligand-Target Pair