Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 294.3 BDBM50299540Purchase

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50299540 (CHEMBL569638 | N-(2,5-dimethoxybenzyl)quinolin-3-a...) Show SMILES COc1ccc(OC)c(CNc2cnc3ccccc3c2)c1 Show InChI InChI=1S/C18H18N2O2/c1-21-16-7-8-18(22-2)14(10-16)11-19-15-9-13-5-3-4-6-17(13)20-12-15/h3-10,12,19H,11H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Medical Research Curated by ChEMBL					Assay Description Inhibition of TNAP transfected in african green monkey COS1 cells by colorimetric assay				J Med Chem 52: 6919-25 (2009) Article DOI: 10.1021/jm900383s BindingDB Entry DOI: 10.7270/Q2WS8T9M
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50299540 (CHEMBL569638 | N-(2,5-dimethoxybenzyl)quinolin-3-a...) Show SMILES COc1ccc(OC)c(CNc2cnc3ccccc3c2)c1 Show InChI InChI=1S/C18H18N2O2/c1-21-16-7-8-18(22-2)14(10-16)11-19-15-9-13-5-3-4-6-17(13)20-12-15/h3-10,12,19H,11H2,1-2H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2CR5RRG
					More data for this Ligand-Target Pair