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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Protein-tyrosine sulfotransferase 2' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Protein-tyrosine sulfotransferase 2


(Homo sapiens)
BDBM50109107
PNG
(6,8-Dichloro-4-oxo-4H-chromene-3-carbaldehyde O-{5...)
Show SMILES Oc1c(Br)cc(\C=N\OCCCCCO\N=C\c2coc3c(Cl)cc(Cl)cc3c2=O)cc1Br
Show InChI InChI=1S/C22H18Br2Cl2N2O5/c23-17-6-13(7-18(24)21(17)30)10-27-32-4-2-1-3-5-33-28-11-14-12-31-22-16(20(14)29)8-15(25)9-19(22)26/h6-12,30H,1-5H2/b27-10+,28-11+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory activity of compound was determined against human tyrosylprotein sulfotransferase-2 (hTPST-2) using [35S]-PAPS radioligand


Bioorg Med Chem Lett 12: 329-32 (2002)

More data for this
Ligand-Target Pair
Protein-tyrosine sulfotransferase 2


(Homo sapiens)
BDBM50109104
PNG
(6,8-Dichloro-4-oxo-4H-chromene-3-carbaldehyde O-{5...)
Show SMILES Oc1c([CH+][N-]OCCCCCO[N-][CH+]c2coc3c(Cl)cc(Cl)cc3c2=O)cc(Br)cc1[N+]([O-])=O
Show InChI InChI=1S/C22H18BrCl2N3O7/c23-15-6-13(21(30)19(7-15)28(31)32)10-26-34-4-2-1-3-5-35-27-11-14-12-33-22-17(20(14)29)8-16(24)9-18(22)25/h6-12,30H,1-5H2
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
PubMed
n/an/a 4.00E+4n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory activity of compound was determined against human tyrosylprotein sulfotransferase-2 (hTPST-2) using [35S]-PAPS radioligand


Bioorg Med Chem Lett 12: 329-32 (2002)

More data for this
Ligand-Target Pair
Protein-tyrosine sulfotransferase 2


(Homo sapiens)
BDBM50109108
PNG
(3,5-Dibromo-4-hydroxy-benzaldehyde O-methyl-oxime ...)
Show SMILES CO\N=C\c1cc(Br)c(O)c(Br)c1
Show InChI InChI=1S/C8H7Br2NO2/c1-13-11-4-5-2-6(9)8(12)7(10)3-5/h2-4,12H,1H3/b11-4+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
AffyNet 
PubMed
n/an/a 4.25E+5n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory activity of compound was determined against human tyrosylprotein sulfotransferase-2 (hTPST-2) using [35S]-PAPS radioligand


Bioorg Med Chem Lett 12: 329-32 (2002)

More data for this
Ligand-Target Pair
Protein-tyrosine sulfotransferase 2


(Homo sapiens)
BDBM50109106
PNG
(5-Bromo-2-hydroxy-3-nitro-benzaldehyde O-methyl-ox...)
Show SMILES CO[N-][CH+]c1cc(Br)cc(c1O)[N+]([O-])=O
Show InChI InChI=1S/C8H7BrN2O4/c1-15-10-4-5-2-6(9)3-7(8(5)12)11(13)14/h2-4,12H,1H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory activity of compound was determined against human tyrosylprotein sulfotransferase-2 (hTPST-2) using [35S]-PAPS radioligand


Bioorg Med Chem Lett 12: 329-32 (2002)

More data for this
Ligand-Target Pair
Protein-tyrosine sulfotransferase 2


(Homo sapiens)
BDBM50109105
PNG
(6,8-Dichloro-4-oxo-4H-chromene-3-carbaldehyde O-me...)
Show SMILES CO\N=C\c1coc2c(Cl)cc(Cl)cc2c1=O
Show InChI InChI=1S/C11H7Cl2NO3/c1-16-14-4-6-5-17-11-8(10(6)15)2-7(12)3-9(11)13/h2-5H,1H3/b14-4+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
AffyNet 
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory activity of compound was determined against human tyrosylprotein sulfotransferase-2 (hTPST-2) using [35S]-PAPS radioligand


Bioorg Med Chem Lett 12: 329-32 (2002)

More data for this
Ligand-Target Pair