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BDBM124261 2-((5-Bromo-2-oxybenzylidene)amino)benzoato-diaqua-oxovanadium(IV) (2)

SMILES: [OH2+][V]12([OH2+])(=O)OC(=O)c3ccccc3[N]1=Cc1cc(ccc1O2)[N+]([O-])=O

InChI Key: InChIKey=IMZBFWOULYINGI-BWUXSGITSA-L

Data: 5 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 124261   
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
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM124261
PNG
(2-((5-Bromo-2-oxybenzylidene)amino)benzoato-diaqua...)
Show SMILES [OH2+][V]12([OH2+])(=O)OC(=O)c3ccccc3[N]1=Cc1cc(ccc1O2)[N+]([O-])=O |c:15|
Show InChI InChI=1S/C14H10N2O5.2H2O.O.V/c17-13-6-5-10(16(20)21)7-9(13)8-15-12-4-2-1-3-11(12)14(18)19;;;;/h1-8,17H,(H,18,19);2*1H2;;/q;;;;+4/p-2/b15-8+;;;;
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Article
PubMed
n/an/a 230n/an/an/an/a7.2n/a



Shanxi University



Assay Description
The assays were performed in 20 mM MOPS buffer, pH 7.2, containing 50 mM NaCl and 2 mM GSH. Compounds were dissolved in DMSO and diluted to various c...


Dalton Trans 41: 11116-24 (2012)


Article DOI: 10.1039/c2dt30198a
BindingDB Entry DOI: 10.7270/Q2DZ070W
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 2


(Homo sapiens (Human))
BDBM124261
PNG
(2-((5-Bromo-2-oxybenzylidene)amino)benzoato-diaqua...)
Show SMILES [OH2+][V]12([OH2+])(=O)OC(=O)c3ccccc3[N]1=Cc1cc(ccc1O2)[N+]([O-])=O |c:15|
Show InChI InChI=1S/C14H10N2O5.2H2O.O.V/c17-13-6-5-10(16(20)21)7-9(13)8-15-12-4-2-1-3-11(12)14(18)19;;;;/h1-8,17H,(H,18,19);2*1H2;;/q;;;;+4/p-2/b15-8+;;;;
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KEGG

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antibodypedia
GoogleScholar
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UniChem

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Article
PubMed
n/an/a 1.30E+3n/an/an/an/a7.2n/a



Shanxi University



Assay Description
The assays were performed in 20 mM MOPS buffer, pH 7.2, containing 50 mM NaCl and 2 mM GSH. Compounds were dissolved in DMSO and diluted to various c...


Dalton Trans 41: 11116-24 (2012)


Article DOI: 10.1039/c2dt30198a
BindingDB Entry DOI: 10.7270/Q2DZ070W
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 11


(Homo sapiens (Human))
BDBM124261
PNG
(2-((5-Bromo-2-oxybenzylidene)amino)benzoato-diaqua...)
Show SMILES [OH2+][V]12([OH2+])(=O)OC(=O)c3ccccc3[N]1=Cc1cc(ccc1O2)[N+]([O-])=O |c:15|
Show InChI InChI=1S/C14H10N2O5.2H2O.O.V/c17-13-6-5-10(16(20)21)7-9(13)8-15-12-4-2-1-3-11(12)14(18)19;;;;/h1-8,17H,(H,18,19);2*1H2;;/q;;;;+4/p-2/b15-8+;;;;
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Article
PubMed
n/an/a 4.20E+3n/an/an/an/a7.2n/a



Shanxi University



Assay Description
The assays were performed in 20 mM MOPS buffer, pH 7.2, containing 50 mM NaCl and 2 mM GSH. Compounds were dissolved in DMSO and diluted to various c...


Dalton Trans 41: 11116-24 (2012)


Article DOI: 10.1039/c2dt30198a
BindingDB Entry DOI: 10.7270/Q2DZ070W
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1C


(Homo sapiens (Human))
BDBM124261
PNG
(2-((5-Bromo-2-oxybenzylidene)amino)benzoato-diaqua...)
Show SMILES [OH2+][V]12([OH2+])(=O)OC(=O)c3ccccc3[N]1=Cc1cc(ccc1O2)[N+]([O-])=O |c:15|
Show InChI InChI=1S/C14H10N2O5.2H2O.O.V/c17-13-6-5-10(16(20)21)7-9(13)8-15-12-4-2-1-3-11(12)14(18)19;;;;/h1-8,17H,(H,18,19);2*1H2;;/q;;;;+4/p-2/b15-8+;;;;
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Article
PubMed
n/an/a 1.90E+3n/an/an/an/a7.2n/a



Shanxi University



Assay Description
The assays were performed in 20 mM MOPS buffer, pH 7.2, containing 50 mM NaCl and 2 mM GSH. Compounds were dissolved in DMSO and diluted to various c...


Dalton Trans 41: 11116-24 (2012)


Article DOI: 10.1039/c2dt30198a
BindingDB Entry DOI: 10.7270/Q2DZ070W
More data for this
Ligand-Target Pair
Megakaryocyte protein-tyrosine phosphatase (PTP-MEG2)


(Homo sapiens (Human))
BDBM124261
PNG
(2-((5-Bromo-2-oxybenzylidene)amino)benzoato-diaqua...)
Show SMILES [OH2+][V]12([OH2+])(=O)OC(=O)c3ccccc3[N]1=Cc1cc(ccc1O2)[N+]([O-])=O |c:15|
Show InChI InChI=1S/C14H10N2O5.2H2O.O.V/c17-13-6-5-10(16(20)21)7-9(13)8-15-12-4-2-1-3-11(12)14(18)19;;;;/h1-8,17H,(H,18,19);2*1H2;;/q;;;;+4/p-2/b15-8+;;;;
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 600n/an/an/an/a7.2n/a



Shanxi University



Assay Description
The assays were performed in 20 mM MOPS buffer, pH 7.2, containing 50 mM NaCl and 2 mM GSH. Compounds were dissolved in DMSO and diluted to various c...


Dalton Trans 41: 11116-24 (2012)


Article DOI: 10.1039/c2dt30198a
BindingDB Entry DOI: 10.7270/Q2DZ070W
More data for this
Ligand-Target Pair