Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 377.3 BDBM50447459

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

Found 3 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, placental type (Homo sapiens (Human))	BDBM50447459 (CHEMBL3115156) Show SMILES O=C(Nc1ccc2OCOc2c1)NS(=O)(=O)c1ccc2[nH]c(=O)oc2c1 Show InChI InChI=1S/C15H11N3O7S/c19-14(16-8-1-4-11-13(5-8)24-7-23-11)18-26(21,22)9-2-3-10-12(6-9)25-15(20)17-10/h1-6H,7H2,(H,17,20)(H2,16,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Sanford-Burnham Medical Research Institute Curated by ChEMBL					Assay Description Inhibition of FLAG-tagged PLAP (unknown origin) expressed in African green monkey COS1 cells after 30 mins by chemiluminescence assay				Bioorg Med Chem Lett 24: 1000-4 (2014) Article DOI: 10.1016/j.bmcl.2013.12.043 BindingDB Entry DOI: 10.7270/Q2ST7RB8
					More data for this Ligand-Target Pair
Intestinal-type alkaline phosphatase (Mus musculus)	BDBM50447459 (CHEMBL3115156) Show SMILES O=C(Nc1ccc2OCOc2c1)NS(=O)(=O)c1ccc2[nH]c(=O)oc2c1 Show InChI InChI=1S/C15H11N3O7S/c19-14(16-8-1-4-11-13(5-8)24-7-23-11)18-26(21,22)9-2-3-10-12(6-9)25-15(20)17-10/h1-6H,7H2,(H,17,20)(H2,16,18,19)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Sanford-Burnham Medical Research Institute Curated by ChEMBL					Assay Description Inhibition of mouse duodenal-specific FLAG-tagged IAP expressed in African green monkey COS1 cells after 30 mins by chemiluminescence assay				Bioorg Med Chem Lett 24: 1000-4 (2014) Article DOI: 10.1016/j.bmcl.2013.12.043 BindingDB Entry DOI: 10.7270/Q2ST7RB8
					More data for this Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme (Homo sapiens (Human))	BDBM50447459 (CHEMBL3115156) Show SMILES O=C(Nc1ccc2OCOc2c1)NS(=O)(=O)c1ccc2[nH]c(=O)oc2c1 Show InChI InChI=1S/C15H11N3O7S/c19-14(16-8-1-4-11-13(5-8)24-7-23-11)18-26(21,22)9-2-3-10-12(6-9)25-15(20)17-10/h1-6H,7H2,(H,17,20)(H2,16,18,19)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Sanford-Burnham Medical Research Institute Curated by ChEMBL					Assay Description Inhibition of FLAG-tagged TNAP (unknown origin) expressed in African green monkey COS1 cells after 30 mins by chemiluminescence assay				Bioorg Med Chem Lett 24: 1000-4 (2014) Article DOI: 10.1016/j.bmcl.2013.12.043 BindingDB Entry DOI: 10.7270/Q2ST7RB8
					More data for this Ligand-Target Pair