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BDBM50116812 4-Sulfamoyloxy-benzoic acid decyl ester::CHEMBL305637

SMILES: CCCCCCCCCCOC(=O)c1ccc(OS(N)(=O)=O)cc1

InChI Key: InChIKey=DLRHBYZXPMZRRW-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50116812   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Steryl-sulfatase


(Homo sapiens (Human))
BDBM50116812
PNG
(4-Sulfamoyloxy-benzoic acid decyl ester | CHEMBL30...)
Show SMILES CCCCCCCCCCOC(=O)c1ccc(OS(N)(=O)=O)cc1
Show InChI InChI=1S/C17H27NO5S/c1-2-3-4-5-6-7-8-9-14-22-17(19)15-10-12-16(13-11-15)23-24(18,20)21/h10-13H,2-9,14H2,1H3,(H2,18,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.24E+4n/an/an/an/an/an/a



Kingston University

Curated by ChEMBL


Assay Description
Inhibition of estrone sulfatase


Bioorg Med Chem Lett 14: 605-9 (2004)


BindingDB Entry DOI: 10.7270/Q2H132K6
More data for this
Ligand-Target Pair
Steryl-sulfatase


(Homo sapiens (Human))
BDBM50116812
PNG
(4-Sulfamoyloxy-benzoic acid decyl ester | CHEMBL30...)
Show SMILES CCCCCCCCCCOC(=O)c1ccc(OS(N)(=O)=O)cc1
Show InChI InChI=1S/C17H27NO5S/c1-2-3-4-5-6-7-8-9-14-22-17(19)15-10-12-16(13-11-15)23-24(18,20)21/h10-13H,2-9,14H2,1H3,(H2,18,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.24E+4n/an/an/an/an/an/a



Kingston University

Curated by ChEMBL


Assay Description
Inhibitory activity against Estrone Sulfatase


Bioorg Med Chem Lett 12: 2391-4 (2002)


BindingDB Entry DOI: 10.7270/Q2S75GV2
More data for this
Ligand-Target Pair