BDBM50097925 CHEMBL82508::Sulfamic acid 4-formyl-phenyl ester

SMILES: NS(=O)(=O)Oc1ccc(C=O)cc1

InChI Key: InChIKey=MZXYZVHVJHGZKF-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50097925   

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
Steryl-sulfatase (Homo sapiens (Human))	BDBM50097925 (CHEMBL82508 | Sulfamic acid 4-formyl-phenyl ester) Show SMILES NS(=O)(=O)Oc1ccc(C=O)cc1 Show InChI InChI=1S/C7H7NO4S/c8-13(10,11)12-7-3-1-6(5-9)2-4-7/h1-5H,(H2,8,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Punjabi University Curated by ChEMBL					Assay Description Inhibition of placental microsomal estrone sulfatase (unknown origin) using [3H]-estrone sulphate as substrate incubated for 20 mins by scintillation...				Eur J Med Chem 114: 170-90 (2016) BindingDB Entry DOI: 10.7270/Q26Q2048
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50097925 (CHEMBL82508 | Sulfamic acid 4-formyl-phenyl ester) Show SMILES NS(=O)(=O)Oc1ccc(C=O)cc1 Show InChI InChI=1S/C7H7NO4S/c8-13(10,11)12-7-3-1-6(5-9)2-4-7/h1-5H,(H2,8,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.54E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description Inhibition of Estrone sulfatase				Bioorg Med Chem Lett 11: 841-4 (2001) BindingDB Entry DOI: 10.7270/Q2JW8FFS
					More data for this Ligand-Target Pair
Steryl-sulfatase (Homo sapiens (Human))	BDBM50097925 (CHEMBL82508 | Sulfamic acid 4-formyl-phenyl ester) Show SMILES NS(=O)(=O)Oc1ccc(C=O)cc1 Show InChI InChI=1S/C7H7NO4S/c8-13(10,11)12-7-3-1-6(5-9)2-4-7/h1-5H,(H2,8,10,11)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.54E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kingston University Curated by ChEMBL					Assay Description Inhibition of estrone sulfatase (ES)				Bioorg Med Chem Lett 11: 2525-8 (2001) BindingDB Entry DOI: 10.7270/Q2CF9QMP
					More data for this Ligand-Target Pair