BDBM80804 2-Ethyl-3-methyl-1-methylamino-benzo[4,5]imidazo[1,2-a]pyridine-4-carbonitrile::2-ethyl-3-methyl-1-(methylamino)-4-pyrido[1,2-a]benzimidazolecarbonitrile::2-ethyl-3-methyl-1-(methylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile::MLS001198575::SMR000558985::cid_779734

SMILES: CCc1c(C)c(C#N)c2nc3ccccc3n2c1NC

InChI Key: InChIKey=DSLDSOQPUFCHSI-UHFFFAOYSA-N

Data: 2 EC50

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 = 80804   

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
Hexokinase type I (Homo sapiens (Human))	BDBM80804 (2-Ethyl-3-methyl-1-methylamino-benzo[4,5]imidazo[1...) Show SMILES CCc1c(C)c(C#N)c2nc3ccccc3n2c1NC Show InChI InChI=1S/C16H16N4/c1-4-11-10(2)12(9-17)16-19-13-7-5-6-8-14(13)20(16)15(11)18-3/h5-8,18H,4H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	2.11E+4	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2765CSM
					More data for this Ligand-Target Pair
putative hexokinase HKDC1 (Homo sapiens (Human))	BDBM80804 (2-Ethyl-3-methyl-1-methylamino-benzo[4,5]imidazo[1...) Show SMILES CCc1c(C)c(C#N)c2nc3ccccc3n2c1NC Show InChI InChI=1S/C16H16N4/c1-4-11-10(2)12(9-17)16-19-13-7-5-6-8-14(13)20(16)15(11)18-3/h5-8,18H,4H2,1-3H3	GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	4.48E+4	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2R78CQV
					More data for this Ligand-Target Pair