BDBM50397044 CHEMBL2171205

SMILES: CN(C)Cc1cccc(COc2nc(N)nc3nc[nH]c23)c1

InChI Key: InChIKey=SGMHYUAQYLJKMP-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 = 50397044   

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
6-O-methylguanine-DNA methyltransferase (Homo sapiens (Human))	BDBM50397044 (CHEMBL2171205) Show SMILES CN(C)Cc1cccc(COc2nc(N)nc3nc[nH]c23)c1 Show InChI InChI=1S/C15H18N6O/c1-21(2)7-10-4-3-5-11(6-10)8-22-14-12-13(18-9-17-12)19-15(16)20-14/h3-6,9H,7-8H2,1-2H3,(H3,16,17,18,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description Inhibition of AGT in human HL60 cells assessed as AGT levels using [3H]AGT after 2 hrs				Bioorg Med Chem Lett 22: 6242-7 (2012) Article DOI: 10.1016/j.bmcl.2012.08.008 BindingDB Entry DOI: 10.7270/Q2F47Q7H
					More data for this Ligand-Target Pair