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BDBM50297924 CHEMBL232233::H2NSO3H::sodium sulfamate

SMILES: NS([O-])(=O)=O

InChI Key: InChIKey=IIACRCGMVDHOTQ-UHFFFAOYSA-M

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 = 50297924   
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
Astrosclerin-3


(Astrosclera willeyana)
BDBM50297924
PNG
(CHEMBL232233 | H2NSO3H | sodium sulfamate)
Show SMILES NS([O-])(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)/p-1
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Article
PubMed
1.30E+4n/an/an/an/an/an/an/an/a



Slovak Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of Astrosclera willeyana recombinant GST-tagged astrosclerin 3 expressed in Escherichia coli BL21-DE3-RIPL cells preincubated for 15 mins ...


Bioorg Med Chem Lett 22: 1314-6 (2012)


Article DOI: 10.1016/j.bmcl.2011.12.085
BindingDB Entry DOI: 10.7270/Q2W66M7M
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50297924
PNG
(CHEMBL232233 | H2NSO3H | sodium sulfamate)
Show SMILES NS([O-])(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)/p-1
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PubMed
2.10E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


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


Bioorg Med Chem Lett 22: 7142-5 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.065
BindingDB Entry DOI: 10.7270/Q2930VB8
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50297924
PNG
(CHEMBL232233 | H2NSO3H | sodium sulfamate)
Show SMILES NS([O-])(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)/p-1
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PubMed
2.10E+4n/an/an/an/an/an/a7.5n/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 15 mins by CO2 hydrase assay at pH 7.5


Bioorg Med Chem 19: 1847-51 (2011)


Article DOI: 10.1016/j.bmc.2011.02.015
BindingDB Entry DOI: 10.7270/Q2QN672R
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (Human))
BDBM50297924
PNG
(CHEMBL232233 | H2NSO3H | sodium sulfamate)
Show SMILES NS([O-])(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)/p-1
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KEGG
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Article
PubMed
2.10E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human CA1 incubated for 15 mins prior to testing by stopped flow CO2 hydrase assay


Bioorg Med Chem Lett 25: 5485-9 (2015)


Article DOI: 10.1016/j.bmcl.2015.10.074
BindingDB Entry DOI: 10.7270/Q2K93BJF
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Candida glabrata)
BDBM50297924
PNG
(CHEMBL232233 | H2NSO3H | sodium sulfamate)
Show SMILES NS([O-])(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)/p-1
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PubMed
1.10E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of Candida glabrata carbonic anhydrase by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4802-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.048
BindingDB Entry DOI: 10.7270/Q2R212BT
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50297924
PNG
(CHEMBL232233 | H2NSO3H | sodium sulfamate)
Show SMILES NS([O-])(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)/p-1
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UniChem

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Article
PubMed
3.90E+5n/an/an/an/an/an/a7.5n/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 15 mins by CO2 hydrase assay at pH 7.5


Bioorg Med Chem 19: 1847-51 (2011)


Article DOI: 10.1016/j.bmc.2011.02.015
BindingDB Entry DOI: 10.7270/Q2QN672R
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50297924
PNG
(CHEMBL232233 | H2NSO3H | sodium sulfamate)
Show SMILES NS([O-])(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)/p-1
PDB
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CHEMBL
KEGG
PC cid
PC sid
UniChem

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Article
PubMed
3.90E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human CA2 incubated for 15 mins prior to testing by stopped flow CO2 hydrase assay


Bioorg Med Chem Lett 25: 5485-9 (2015)


Article DOI: 10.1016/j.bmcl.2015.10.074
BindingDB Entry DOI: 10.7270/Q2K93BJF
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50297924
PNG
(CHEMBL232233 | H2NSO3H | sodium sulfamate)
Show SMILES NS([O-])(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)/p-1
PDB
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Reactome pathway
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CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.90E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


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


Bioorg Med Chem Lett 22: 7142-5 (2012)


Article DOI: 10.1016/j.bmcl.2012.09.065
BindingDB Entry DOI: 10.7270/Q2930VB8
More data for this
Ligand-Target Pair