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BDBM50118566 CHEMBL137262::Sulfamic acid 4-oxo-2-propyl-4H-chromen-6-yl ester

SMILES: CCCc1cc(=O)c2cc(OS(N)(=O)=O)ccc2o1

InChI Key: InChIKey=FMQZZOIPCSCGMG-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50118566   
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))
BDBM50118566
PNG
(CHEMBL137262 | Sulfamic acid 4-oxo-2-propyl-4H-chr...)
Show SMILES CCCc1cc(=O)c2cc(OS(N)(=O)=O)ccc2o1
Show InChI InChI=1S/C12H13NO5S/c1-2-3-8-7-11(14)10-6-9(18-19(13,15)16)4-5-12(10)17-8/h4-7H,2-3H2,1H3,(H2,13,15,16)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 722n/an/an/an/an/an/a



Novartis Research Institute Vienna

Curated by ChEMBL


Assay Description
Inhibitory activity against purified human steroid sulfatase (STS)


J Med Chem 45: 4310-20 (2002)


BindingDB Entry DOI: 10.7270/Q2BZ66SF
More data for this
Ligand-Target Pair