BDBM50180789 1,2-bis(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethane::7-methyl-3-(2-(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)ethyl)-[1,2,4]triazolo[4,3-a]pyridine::CHEMBL382617::NSC-303530

SMILES: Cc1ccn2c(CCc3nnc4cc(C)ccn34)nnc2c1

InChI Key: InChIKey=YZJYQGRMFVKPAP-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 = 50180789   

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
DNA (cytosine-5)-methyltransferase 1 (DNMT1) (Homo sapiens (Human))	BDBM50180789 (1,2-bis(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-y...) Show SMILES Cc1ccn2c(CCc3nnc4cc(C)ccn34)nnc2c1 Show InChI InChI=1S/C16H16N6/c1-11-5-7-21-13(17-19-15(21)9-11)3-4-14-18-20-16-10-12(2)6-8-22(14)16/h5-10H,3-4H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Polish Academy of Sciences Curated by ChEMBL					Assay Description Inhibitory activity against DNA methyl transferase in leukemic NALM6 cells				J Med Chem 49: 678-83 (2006) Article DOI: 10.1021/jm050844z BindingDB Entry DOI: 10.7270/Q20G3JR2
					More data for this Ligand-Target Pair
M.SssI methyltransferase (Spiroplasma monobiae strain MQ-1)	BDBM50180789 (1,2-bis(7-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-y...) Show SMILES Cc1ccn2c(CCc3nnc4cc(C)ccn34)nnc2c1 Show InChI InChI=1S/C16H16N6/c1-11-5-7-21-13(17-19-15(21)9-11)3-4-14-18-20-16-10-12(2)6-8-22(14)16/h5-10H,3-4H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Polish Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of recombinant CpG methylase M.SssI				J Med Chem 49: 678-83 (2006) Article DOI: 10.1021/jm050844z BindingDB Entry DOI: 10.7270/Q20G3JR2
					More data for this Ligand-Target Pair