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Found 10 hits Enz. Inhib. hit(s) with Target = 'Polypeptide N-acetylgalactosaminyltransferase 2' and Ligand = 'BDBM50215545'   
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
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
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1.07E+3n/an/an/an/an/an/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Competitive inhibition of human recombinant FLAG-tagged ppGalNAcT2 expressed in HEK293 cells using EA2 peptide as substrate by HPLC-based enzyme assa...


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
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6.15E+3n/an/an/an/an/an/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Non-competitive inhibition of human recombinant FLAG-tagged ppGalNAcT2 expressed in HEK293 cells using UDP-GalNAc as substrate by HPLC-based enzyme a...


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
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PubMed
n/an/a 760n/an/an/an/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Inhibition of catalytic activity of human recombinant FLAG-tagged ppGalNAcT2 expressed in HEK293T cells and using 5-FAM labelled-EA2 peptide as subst...


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
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n/an/a 1.14E+3n/an/an/an/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Inhibition of catalytic activity of human recombinant FLAG-tagged ppGalNAcT2 using Muc2 peptide as substrate incubated for 30 mins by HPLC-based enzy...


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
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PubMed
n/an/a 1.25E+3n/an/an/an/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Inhibition of catalytic activity of human recombinant FLAG-tagged ppGalNAcT2 using Muc7 peptide as substrate incubated for 30 mins by HPLC-based enzy...


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
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PubMed
n/an/a 2.07E+3n/an/an/an/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Inhibition of catalytic activity of human recombinant FLAG-tagged ppGalNAcT2 using Muc5AC peptide as substrate incubated for 30 mins by HPLC-based en...


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
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Article
PubMed
n/an/a 3.12E+3n/an/an/an/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Inhibition of catalytic activity of human recombinant FLAG-tagged ppGalNAcT2 W282A mutant expressed in HEK293 cells using EA2 peptide as substrate by...


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
PDB

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CHEMBL
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Article
PubMed
n/an/an/a 294n/an/an/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Binding affinity of human recombinant FLAG-tagged ppGalNAcT2 expressed in HEK293 cells assessed as dissociation constant by SPR analysis


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
PDB

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CHEMBL
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Article
PubMed
n/an/an/an/an/an/a 3.53E+3n/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Binding affinity of human recombinant FLAG-tagged ppGalNAcT2 expressed in HEK293 cells assessed as association rate by SPR analysis


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair
Polypeptide N-acetylgalactosaminyltransferase 2


(Homo sapiens (Human))
BDBM50215545
PNG
(CHEMBL6338)
Show SMILES Oc1ccc2c3cc(O)c(O)cc3c(=O)oc2c1O
Show InChI InChI=1S/C13H8O6/c14-8-2-1-5-6-3-9(15)10(16)4-7(6)13(18)19-12(5)11(8)17/h1-4,14-17H
PDB

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CHEMBL
MCE
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Article
PubMed
n/an/an/an/an/a 0.00104n/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Binding affinity of human recombinant FLAG-tagged ppGalNAcT2 expressed in HEK293 cells assessed as dissociation rate by SPR analysis


Bioorg Med Chem 27: 3372-3382 (2019)


Article DOI: 10.1016/j.bmc.2019.06.020
BindingDB Entry DOI: 10.7270/Q2988BDQ
More data for this
Ligand-Target Pair