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BDBM62319 borate (B4O7 2-)::tetraborate

SMILES: [O-]B1OB2OB([O-])OB(O1)O2

InChI Key: InChIKey=GDTSJMKGXGJFGQ-UHFFFAOYSA-N

Data: 8 KI

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 8 hits for monomerid = 62319   
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
α-Carbonic anhydrase (αCA)


(Helicobacter pylori)
BDBM62319
PNG
(borate (B4O7 2-) | tetraborate)
Show SMILES [O-]B1OB2OB([O-])OB(O1)O2
Show InChI InChI=1S/B4O7/c5-1-7-3-9-2(6)10-4(8-1)11-3/q-2
PDB

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UniChem

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Article
PubMed
5.60E+5 -4.43n/an/an/an/an/a7.525



Università degli Studi di Firenze



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity Khalifah RG. The carbon dioxide hy...


J Enzyme Inhib Med Chem 28: 388-91 (2013)


Article DOI: 10.3109/14756366.2011.649268
BindingDB Entry DOI: 10.7270/Q2S75F7K
More data for this
Ligand-Target Pair
Alpha-carbonic anhydrase


(Helicobacter pylori (strain G27))
BDBM62319
PNG
(borate (B4O7 2-) | tetraborate)
Show SMILES [O-]B1OB2OB([O-])OB(O1)O2
Show InChI InChI=1S/B4O7/c5-1-7-3-9-2(6)10-4(8-1)11-3/q-2
PDB

UniProtKB/TrEMBL

GoogleScholar
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PC cid
PC sid
UniChem

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Article
PubMed
5.60E+5 -4.36n/an/an/an/an/a7.520



Universit£ degli Studi di Firenze



Assay Description
Inhibition of Vibrio cholerae alpha carbonic anhydrase preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 24: 3413-7 (2016)


Article DOI: 10.1016/j.bmc.2016.05.029
BindingDB Entry DOI: 10.7270/Q2W9583B
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM62319
PNG
(borate (B4O7 2-) | tetraborate)
Show SMILES [O-]B1OB2OB([O-])OB(O1)O2
Show InChI InChI=1S/B4O7/c5-1-7-3-9-2(6)10-4(8-1)11-3/q-2
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt
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PC cid
PC sid
UniChem

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Article
PubMed
6.40E+5 -4.28n/an/an/an/an/a7.520



Universit£ degli Studi di Firenze



Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 24: 3413-7 (2016)


Article DOI: 10.1016/j.bmc.2016.05.029
BindingDB Entry DOI: 10.7270/Q2W9583B
More data for this
Ligand-Target Pair
β-Carbonic anhydrase (βCA)


(Helicobacter pylori)
BDBM62319
PNG
(borate (B4O7 2-) | tetraborate)
Show SMILES [O-]B1OB2OB([O-])OB(O1)O2
Show InChI InChI=1S/B4O7/c5-1-7-3-9-2(6)10-4(8-1)11-3/q-2
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

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Article
PubMed
6.80E+5 -4.32n/an/an/an/an/a7.525



Università degli Studi di Firenze



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity Khalifah RG. The carbon dioxide hy...


J Enzyme Inhib Med Chem 28: 388-91 (2013)


Article DOI: 10.3109/14756366.2011.649268
BindingDB Entry DOI: 10.7270/Q2S75F7K
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM62319
PNG
(borate (B4O7 2-) | tetraborate)
Show SMILES [O-]B1OB2OB([O-])OB(O1)O2
Show InChI InChI=1S/B4O7/c5-1-7-3-9-2(6)10-4(8-1)11-3/q-2
PDB
MMDB

Reactome pathway
KEGG

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UniProtKB/TrEMBL

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DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem

Similars

Article
PubMed
9.50E+5 -4.05n/an/an/an/an/a7.520



Universit£ degli Studi di Firenze



Assay Description
Inhibition of Helicobacter pylori alpha carbonic anhydrase preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 24: 3413-7 (2016)


Article DOI: 10.1016/j.bmc.2016.05.029
BindingDB Entry DOI: 10.7270/Q2W9583B
More data for this
Ligand-Target Pair
Beta-carbonic anhydrase


(Vibrio cholerae)
BDBM62319
PNG
(borate (B4O7 2-) | tetraborate)
Show SMILES [O-]B1OB2OB([O-])OB(O1)O2
Show InChI InChI=1S/B4O7/c5-1-7-3-9-2(6)10-4(8-1)11-3/q-2
PDB

UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

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Article
PubMed
3.40E+6 -3.31n/an/an/an/an/a7.520



Universit£ degli Studi di Firenze



Assay Description
Inhibition of Vibrio cholerae carbonic anhydrase beta preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 24: 3413-7 (2016)


Article DOI: 10.1016/j.bmc.2016.05.029
BindingDB Entry DOI: 10.7270/Q2W9583B
More data for this
Ligand-Target Pair
Gamma-carbonic anhydrase


(Vibrio cholerae)
BDBM62319
PNG
(borate (B4O7 2-) | tetraborate)
Show SMILES [O-]B1OB2OB([O-])OB(O1)O2
Show InChI InChI=1S/B4O7/c5-1-7-3-9-2(6)10-4(8-1)11-3/q-2
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

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Article
PubMed
7.20E+6 -2.87n/an/an/an/an/a7.520



Universit£ degli Studi di Firenze



Assay Description
Inhibition of Vibrio cholerae recombinant carbonic anhydrase gamma expressed in Escherichia coli DE3 cells preincubated for 15 mins by stopped-flow C...


Bioorg Med Chem 24: 3413-7 (2016)


Article DOI: 10.1016/j.bmc.2016.05.029
BindingDB Entry DOI: 10.7270/Q2W9583B
More data for this
Ligand-Target Pair
Alpha-carbonic anhydrase


(Vibrio cholerae)
BDBM62319
PNG
(borate (B4O7 2-) | tetraborate)
Show SMILES [O-]B1OB2OB([O-])OB(O1)O2
Show InChI InChI=1S/B4O7/c5-1-7-3-9-2(6)10-4(8-1)11-3/q-2
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
1.66E+7 -2.39n/an/an/an/an/a7.520



Universit£ degli Studi di Firenze



Assay Description
Inhibition of Flaveria bidentis carbonic anhydrase 1 preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 24: 3413-7 (2016)


Article DOI: 10.1016/j.bmc.2016.05.029
BindingDB Entry DOI: 10.7270/Q2W9583B
More data for this
Ligand-Target Pair