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BDBM124264 Bis(4-nitro-2-((phenylimino)methyl)phenolate)-oxovanadium(IV) (5)

SMILES: [O-][N+](=O)c1ccc2O[V]3(=O)(Oc4ccc(cc4C=[N]3c3ccccc3)[N+]([O-])=O)[N](=Cc2c1)c1ccccc1

InChI Key: InChIKey=CQZKRCOWOCIEML-YOMCRPSHSA-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 = 124264   
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))
BDBM124264
PNG
(Bis(4-nitro-2-((phenylimino)methyl)phenolate)-oxov...)
Show SMILES [O-][N+](=O)c1ccc2O[V]3(=O)(Oc4ccc(cc4C=[N]3c3ccccc3)[N+]([O-])=O)[N](=Cc2c1)c1ccccc1 |c:18,31|
Show InChI InChI=1S/2C13H10N2O3.O.V/c2*16-13-7-6-12(15(17)18)8-10(13)9-14-11-4-2-1-3-5-11;;/h2*1-9,16H;;/q;;;+2/p-2/b2*14-9+;;
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Article
PubMed
n/an/a 930n/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))
BDBM124264
PNG
(Bis(4-nitro-2-((phenylimino)methyl)phenolate)-oxov...)
Show SMILES [O-][N+](=O)c1ccc2O[V]3(=O)(Oc4ccc(cc4C=[N]3c3ccccc3)[N+]([O-])=O)[N](=Cc2c1)c1ccccc1 |c:18,31|
Show InChI InChI=1S/2C13H10N2O3.O.V/c2*16-13-7-6-12(15(17)18)8-10(13)9-14-11-4-2-1-3-5-11;;/h2*1-9,16H;;/q;;;+2/p-2/b2*14-9+;;
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KEGG

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antibodypedia
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UniChem

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Article
PubMed
n/an/a 1.40E+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))
BDBM124264
PNG
(Bis(4-nitro-2-((phenylimino)methyl)phenolate)-oxov...)
Show SMILES [O-][N+](=O)c1ccc2O[V]3(=O)(Oc4ccc(cc4C=[N]3c3ccccc3)[N+]([O-])=O)[N](=Cc2c1)c1ccccc1 |c:18,31|
Show InChI InChI=1S/2C13H10N2O3.O.V/c2*16-13-7-6-12(15(17)18)8-10(13)9-14-11-4-2-1-3-5-11;;/h2*1-9,16H;;/q;;;+2/p-2/b2*14-9+;;
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Article
PubMed
n/an/a 2.60E+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))
BDBM124264
PNG
(Bis(4-nitro-2-((phenylimino)methyl)phenolate)-oxov...)
Show SMILES [O-][N+](=O)c1ccc2O[V]3(=O)(Oc4ccc(cc4C=[N]3c3ccccc3)[N+]([O-])=O)[N](=Cc2c1)c1ccccc1 |c:18,31|
Show InChI InChI=1S/2C13H10N2O3.O.V/c2*16-13-7-6-12(15(17)18)8-10(13)9-14-11-4-2-1-3-5-11;;/h2*1-9,16H;;/q;;;+2/p-2/b2*14-9+;;
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PubMed
n/an/a 2.50E+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))
BDBM124264
PNG
(Bis(4-nitro-2-((phenylimino)methyl)phenolate)-oxov...)
Show SMILES [O-][N+](=O)c1ccc2O[V]3(=O)(Oc4ccc(cc4C=[N]3c3ccccc3)[N+]([O-])=O)[N](=Cc2c1)c1ccccc1 |c:18,31|
Show InChI InChI=1S/2C13H10N2O3.O.V/c2*16-13-7-6-12(15(17)18)8-10(13)9-14-11-4-2-1-3-5-11;;/h2*1-9,16H;;/q;;;+2/p-2/b2*14-9+;;
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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 3.20E+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