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Target
Sequence
Name
&
Ki
IC50
Kd
EC50
Rate constants
ΔG°
ΔH°
-TΔS°
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Compile Data Set for Download or QSAR
Marvin 2D Structure
The following exact ligands are found in BindingDB
Wt: 26.0
BDBM26984
Purchase
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
40
hits in this display
Target/Host
(Institution)
Ligand
Target/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
k
off
s
-1
k
on
M
-1
s
-1
pH
Temp
°C
Carbonic anhydrase 1
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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 1
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
n/a
n/a
n/a
n/a
n/a
n/a
7.5
n/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 1
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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 1
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
-35.4
n/a
n/a
n/a
n/a
n/a
7.5
20
Universita degli Studi di Firenze
Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...
Bioorg Med Chem Lett
19:
1155
-
8
(2009)
Article DOI:
10.1016/j.bmcl.2008.12.082
BindingDB Entry DOI:
10.7270/Q2KD1W79
More data for this
Ligand-Target Pair
Carbonic anhydrase 1
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Kochi Medical School
Curated by
ChEMBL
Assay Description
Inhibition of human recombinant wild type CA1 by stopped-flow CO2 hydration method
Bioorg Med Chem Lett
23:
256
-
60
(2012)
Article DOI:
10.1016/j.bmcl.2012.10.103
BindingDB Entry DOI:
10.7270/Q2ZC846G
More data for this
Ligand-Target Pair
Carbonic anhydrase 1
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universit£ degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay
Bioorg Med Chem Lett
23:
1636
-
8
(2013)
Article DOI:
10.1016/j.bmcl.2013.01.084
BindingDB Entry DOI:
10.7270/Q2VD70TX
More data for this
Ligand-Target Pair
Carbonic anhydrase 1
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
-35.4
n/a
n/a
n/a
n/a
n/a
7.5
20
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
Carbonic anhydrase 1
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
500
n/a
n/a
n/a
n/a
n/a
n/a
8.3
n/a
Universit£ degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of recombinant human carbonic anhydrase 1 after 15 mins by stopped flow CO2 hydration assay at pH 8.3
Bioorg Med Chem Lett
21:
3591
-
5
(2011)
Article DOI:
10.1016/j.bmcl.2011.04.105
BindingDB Entry DOI:
10.7270/Q2930TGN
More data for this
Ligand-Target Pair
Carbonic anhydrase 15 [19-324]
(Mus musculus (mouse))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
9.40E+3
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...
Bioorg Med Chem Lett
19:
1155
-
8
(2009)
Article DOI:
10.1016/j.bmcl.2008.12.082
BindingDB Entry DOI:
10.7270/Q2KD1W79
More data for this
Ligand-Target Pair
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
-26.4
n/a
n/a
n/a
n/a
n/a
7.5
20
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
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
-26.4
n/a
n/a
n/a
n/a
n/a
7.5
20
Universita degli Studi di Firenze
Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...
Bioorg Med Chem Lett
19:
1155
-
8
(2009)
Article DOI:
10.1016/j.bmcl.2008.12.082
BindingDB Entry DOI:
10.7270/Q2KD1W79
More data for this
Ligand-Target Pair
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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)
Article DOI:
10.1016/j.bmc.2017.02.032
BindingDB Entry DOI:
10.7270/Q2JD5012
More data for this
Ligand-Target Pair
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Kochi Medical School
Curated by
ChEMBL
Assay Description
Inhibition of human recombinant wild type CA2 by stopped-flow CO2 hydration method
Bioorg Med Chem Lett
23:
256
-
60
(2012)
Article DOI:
10.1016/j.bmcl.2012.10.103
BindingDB Entry DOI:
10.7270/Q2ZC846G
More data for this
Ligand-Target Pair
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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 assay
Bioorg Med Chem Lett
23:
1636
-
8
(2013)
Article DOI:
10.1016/j.bmcl.2013.01.084
BindingDB Entry DOI:
10.7270/Q2VD70TX
More data for this
Ligand-Target Pair
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
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PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Istituto di Biostrutture e Bioimmagini
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
23:
1626
-
30
(2013)
Article DOI:
10.1016/j.bmcl.2013.01.087
BindingDB Entry DOI:
10.7270/Q23X8806
More data for this
Ligand-Target Pair
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
8.3
n/a
Universit£ degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibition of recombinant human carbonic anhydrase 2 after 15 mins by stopped flow CO2 hydration assay at pH 8.3
Bioorg Med Chem Lett
21:
3591
-
5
(2011)
Article DOI:
10.1016/j.bmcl.2011.04.105
BindingDB Entry DOI:
10.7270/Q2930TGN
More data for this
Ligand-Target Pair
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
7.5
n/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))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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KEGG
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PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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)
Article DOI:
10.1016/j.bmc.2015.05.029
BindingDB Entry DOI:
10.7270/Q20V8FK8
More data for this
Ligand-Target Pair
Carbonic anhydrase 2
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
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KEGG
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CHEMBL
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PC sid
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Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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KEGG
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CHEMBL
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PC sid
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PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
MMDB
Reactome pathway
KEGG
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CHEMBL
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PC sid
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Article
PubMed
2.00E+4
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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
(Vibrio cholerae serotype O1 (strain ATCC 39315 / E...)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
UniProtKB/TrEMBL
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CHEMBL
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PubMed
3.30E+4
-25.1
n/a
n/a
n/a
n/a
n/a
7.5
20
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
Carbonic anhydrase
(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
UniProtKB/TrEMBL
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CHEMBL
MCE
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PC sid
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PubMed
5.30E+5
n/a
n/a
n/a
n/a
n/a
n/a
8.3
n/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)
Article DOI:
10.1016/j.bmc.2015.05.029
BindingDB Entry DOI:
10.7270/Q20V8FK8
More data for this
Ligand-Target Pair
Carbonic anhydrase
(Helicobacter pylori)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
UniProtKB/TrEMBL
GoogleScholar
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CHEMBL
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PC cid
PC sid
PDB
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Article
PubMed
5.40E+5
-18.7
n/a
n/a
n/a
n/a
n/a
7.5
25
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
(Astrosclera willeyana)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
UniProtKB/TrEMBL
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CHEMBL
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PubMed
6.30E+5
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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
(Methanosarcina thermophila)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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6.80E+5
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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
Carbonic anhydrase
(Methanosarcina thermophila)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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PC sid
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PubMed
6.80E+5
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/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
Carbonic anhydrase
(Methanosarcina thermophila)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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PC sid
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PubMed
6.80E+5
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universit£ degli Studi di Firenze
Curated by
ChEMBL
Assay Description
Inhibitory constant against Zn-Cam (Methanosarcina thermophila)
Bioorg Med Chem Lett
14:
4563
-
7
(2004)
Article DOI:
10.1016/j.bmcl.2004.06.073
BindingDB Entry DOI:
10.7270/Q2H995ZD
More data for this
Ligand-Target Pair
Carbonic anhydrase
(Methanosarcina thermophila)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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CHEMBL
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PubMed
6.80E+5
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Istituto di Biochimica delle Proteine - CNR
Curated by
ChEMBL
Assay Description
Inhibition of Methanosarcina thermophila recombinant gamma-CA by CO2 hydration assay
Bioorg Med Chem Lett
23:
4067
-
71
(2013)
Article DOI:
10.1016/j.bmcl.2013.05.063
BindingDB Entry DOI:
10.7270/Q2HX1F27
More data for this
Ligand-Target Pair
Alpha-carbonic anhydrase
(Helicobacter pylori (strain G27))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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PubMed
7.60E+5
-17.5
n/a
n/a
n/a
n/a
n/a
7.5
20
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
Alpha-carbonic anhydrase
(Helicobacter pylori)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
UniProtKB/TrEMBL
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CHEMBL
MCE
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PC sid
PDB
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PubMed
7.60E+5
-17.8
n/a
n/a
n/a
n/a
n/a
7.5
25
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 4
(Homo sapiens (Human))
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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Reactome pathway
KEGG
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CHEMBL
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PubMed
7.70E+5
n/a
n/a
n/a
n/a
n/a
n/a
n/a
n/a
Universita degli Studi di Firenze
Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...
Bioorg Med Chem Lett
19:
1155
-
8
(2009)
Article DOI:
10.1016/j.bmcl.2008.12.082
BindingDB Entry DOI:
10.7270/Q2KD1W79
More data for this
Ligand-Target Pair
Carbonic anhydrase
(Vibrio cholerae)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
PDB
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PubMed
5.70E+6
-12.6
n/a
n/a
n/a
n/a
n/a
7.5
20
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 family protein
(Vibrio cholerae)
BDBM26984
(CHEMBL1644697 | CN(-1) | cyanide | iminomethanide)
Show SMILES
[C-]#N
Show InChI
InChI=1S/CN/c1-2/q-1
UniProtKB/TrEMBL
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PubMed
8.40E+6
-11.6
n/a
n/a
n/a
n/a
n/a
7.5
20
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