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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with all data for assayid = 10 entry = 50009102   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Steryl-sulfatase


(Homo sapiens (Human))
BDBM50098110
PNG
(CHEMBL11382 | Sulfamic acid 2-oxo-2H-chromen-7-yl ...)
Show SMILES NS(=O)(=O)Oc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C9H7NO5S/c10-16(12,13)15-7-3-1-6-2-4-9(11)14-8(6)5-7/h1-5H,(H2,10,12,13)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2.13E+3n/an/an/an/an/an/a



University of Sharjah

Curated by ChEMBL


Assay Description
Inhibition of human placental steroid sulfatase


Eur J Med Chem 179: 257-271 (2019)


Article DOI: 10.1016/j.ejmech.2019.06.052
BindingDB Entry DOI: 10.7270/Q2B27ZQ2
More data for this
Ligand-Target Pair
Steryl-sulfatase


(Homo sapiens (Human))
BDBM50525480
PNG
(CHEMBL4555404)
Show SMILES NS(=O)(=O)Oc1ccc(CCNC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1
Show InChI InChI=1S/C19H11F21N2O4S/c20-10(21,9(43)42-6-5-7-1-3-8(4-2-7)46-47(41,44)45)11(22,23)12(24,25)13(26,27)14(28,29)15(30,31)16(32,33)17(34,35)18(36,37)19(38,39)40/h1-4H,5-6H2,(H,42,43)(H2,41,44,45)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.18E+3n/an/an/an/an/an/a



University of Sharjah

Curated by ChEMBL


Assay Description
Inhibition of human placental steroid sulfatase


Eur J Med Chem 179: 257-271 (2019)


Article DOI: 10.1016/j.ejmech.2019.06.052
BindingDB Entry DOI: 10.7270/Q2B27ZQ2
More data for this
Ligand-Target Pair