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BDBM50098560 CHEBI:63004::SODIUM BROMIDE::Sodium Bromide

SMILES: [Na+].[Br-]

InChI Key: InChIKey=JHJLBTNAGRQEKS-UHFFFAOYSA-M

Data: 14 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 14 hits for monomerid = 50098560   
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
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
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4.00E+6n/an/an/an/an/an/an/an/a



Istituto di Bioscienze e Biorisorse (IBBR)-CNR

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration method


Bioorg Med Chem Lett 24: 4389-96 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.015
BindingDB Entry DOI: 10.7270/Q28054D1
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
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4.00E+6n/an/an/an/an/an/an/an/a



University of Tampere and Tampere University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase-1 at 20 degC preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 21: 4472-6 (2013)


Article DOI: 10.1016/j.bmc.2013.05.058
BindingDB Entry DOI: 10.7270/Q28S4SV8
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB
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6.30E+7n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration method


Bioorg Med Chem Lett 24: 4402-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.014
BindingDB Entry DOI: 10.7270/Q2348N4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB
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6.30E+7n/an/an/an/an/an/an/an/a



CNR

Curated by ChEMBL


Assay Description
Inhibition of human CA2 incubated for 15 mins by stopped-flow CO2 hydration assay


Bioorg Med Chem 25: 4800-4804 (2017)


Article DOI: 10.1016/j.bmc.2017.07.033
BindingDB Entry DOI: 10.7270/Q2028V0P
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
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6.30E+7n/an/an/an/an/an/an/an/a



University of Tampere and Tampere University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase-2 at 20 degC preincubated for 15 mins by stopped-flow CO2 hydrase assay


Bioorg Med Chem 21: 4472-6 (2013)


Article DOI: 10.1016/j.bmc.2013.05.058
BindingDB Entry DOI: 10.7270/Q28S4SV8
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB
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6.30E+7n/an/an/an/an/an/an/an/a



Italy; Universit£ degliStudi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 assessed as inhibition of CO2 hydration preincubated for 15 mins by Lineweaver-burk plot method


Bioorg Med Chem 25: 575-580 (2017)


Article DOI: 10.1016/j.bmc.2016.11.021
BindingDB Entry DOI: 10.7270/Q2M047FF
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB
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6.30E+7n/an/an/an/an/an/an/an/a



Kochi Medical School

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 by stopped-flow CO2 hydrase assay


Bioorg Med Chem Lett 24: 1127-32 (2014)


Article DOI: 10.1016/j.bmcl.2013.12.124
BindingDB Entry DOI: 10.7270/Q2FX7DDZ
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB
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6.30E+7n/an/an/an/an/an/an/an/a



Istituto di Bioscienze e Biorisorse, CNR

Curated by ChEMBL


Assay Description
Inhibition of recombinant human carbonic anhydrase 2 assessed as inhibition of CO2 hydration incubated for 15 mins prior to testing by stopped flow C...


Bioorg Med Chem 25: 2010-2015 (2017)


BindingDB Entry DOI: 10.7270/Q2JD5012
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB
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PubMed
6.30E+7n/an/an/an/an/an/an/an/a



Istituto di Bioscienze e Biorisorse (IBBR)-CNR

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration method


Bioorg Med Chem Lett 24: 4389-96 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.015
BindingDB Entry DOI: 10.7270/Q28054D1
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB
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6.30E+7n/an/an/an/an/an/an/an/a



Istituto di Bioscienze e Biorisorse

Curated by ChEMBL


Assay Description
Inhibition of human CA2 after 15 mins by stopped-flow/Co2 hydration assay


Bioorg Med Chem 23: 4405-9 (2015)


Article DOI: 10.1016/j.bmc.2015.06.021
BindingDB Entry DOI: 10.7270/Q2JD4ZJ0
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB
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6.30E+7n/an/an/an/an/an/an/an/a



University of Florida

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase-2 by CO2 hydration reaction based colorimetric stopped-flow method


Bioorg Med Chem 23: 4831-8 (2015)


BindingDB Entry DOI: 10.7270/Q20V8FK8
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
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>1.00E+8n/an/an/an/an/an/a8.3n/a



University of Florida

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase-2 by CO2 hydration reaction based colorimetric stopped-flow method


Bioorg Med Chem 23: 4831-8 (2015)


BindingDB Entry DOI: 10.7270/Q20V8FK8
More data for this
Ligand-Target Pair
Gamma-carbonic anhydrase


(Methanosarcina thermophila)
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB

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1.60E+8n/an/an/an/an/an/an/an/a



Istituto di Bioscienze e Biorisorse

Curated by ChEMBL


Assay Description
Inhibition of archaeon Methanosarcina thermophila gamma-CA after 15 mins by stopped-flow/Co2 hydration assay


Bioorg Med Chem 23: 4405-9 (2015)


Article DOI: 10.1016/j.bmc.2015.06.021
BindingDB Entry DOI: 10.7270/Q2JD4ZJ0
More data for this
Ligand-Target Pair
Gamma-carbonic anhydrase


(Methanosarcina thermophila)
BDBM50098560
PNG
(CHEBI:63004 | SODIUM BROMIDE | Sodium Bromide)
Show SMILES [Na+].[Br-]
Show InChI InChI=1S/BrH.Na/h1H;/q;+1/p-1
PDB

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1.60E+8n/an/an/an/an/an/an/an/a



Italy; Universit£ degliStudi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of Methanosarcina thermophila recombinant carbonic anhydrase gamma assessed as inhibition of CO2 hydration preincubated for 15 mins by Lin...


Bioorg Med Chem 25: 575-580 (2017)


Article DOI: 10.1016/j.bmc.2016.11.021
BindingDB Entry DOI: 10.7270/Q2M047FF
More data for this
Ligand-Target Pair