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Compile Data Set for Download or QSAR

Found 529 hits with Last Name = 'kamal' and Initial = 'a'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550947
PNG
(CHEMBL4793493)
Show SMILES Cc1ccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)cc1
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1.90n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550942
PNG
(CHEMBL4783035)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(Nc3ccccc3C(O)=O)ncnc12
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3.80n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM10880
PNG
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)
Show SMILES CC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)
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5.70n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550938
PNG
(CHEMBL4783234)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(N\N=C\c3ccccc3O)ncnc12
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9.80n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550947
PNG
(CHEMBL4793493)
Show SMILES Cc1ccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)cc1
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11n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM10880
PNG
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)
Show SMILES CC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)
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13n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550942
PNG
(CHEMBL4783035)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(Nc3ccccc3C(O)=O)ncnc12
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20n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550944
PNG
(CHEMBL4794296)
Show SMILES COc1ccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)cc1
PDB
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23n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM10880
PNG
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)
Show SMILES CC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)
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25n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550946
PNG
(CHEMBL4758835)
Show SMILES Cc1cccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)c1
PDB
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28n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550945
PNG
(CHEMBL4748481)
Show SMILES Cc1ccccc1Nc1ncnc2n(cc(-c3ccc(Cl)cc3)c12)-c1ccc(cc1)S(N)(=O)=O
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28n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550947
PNG
(CHEMBL4793493)
Show SMILES Cc1ccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)cc1
PDB
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29n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550932
PNG
(CHEMBL4752002)
Show SMILES Nn1cnc2n(cc(-c3ccc(Cl)cc3)c2c1=N)-c1ccc(cc1)S(N)(=O)=O
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32n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550946
PNG
(CHEMBL4758835)
Show SMILES Cc1cccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)c1
PDB
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34n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550943
PNG
(CHEMBL4779357)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(Nc3ccc(Cl)cc3)ncnc12
PDB
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34n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550945
PNG
(CHEMBL4748481)
Show SMILES Cc1ccccc1Nc1ncnc2n(cc(-c3ccc(Cl)cc3)c12)-c1ccc(cc1)S(N)(=O)=O
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34n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550946
PNG
(CHEMBL4758835)
Show SMILES Cc1cccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)c1
PDB
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36n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550955
PNG
(CHEMBL4758179)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(c(C#N)c1\N=C\c1ccccc1O)-c1ccc(Cl)cc1
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40n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550945
PNG
(CHEMBL4748481)
Show SMILES Cc1ccccc1Nc1ncnc2n(cc(-c3ccc(Cl)cc3)c12)-c1ccc(cc1)S(N)(=O)=O
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45n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550942
PNG
(CHEMBL4783035)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(Nc3ccccc3C(O)=O)ncnc12
PDB
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45n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550944
PNG
(CHEMBL4794296)
Show SMILES COc1ccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)cc1
PDB
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46n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550949
PNG
(CHEMBL4761238)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(Cl)ncnc12
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47n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50550938
PNG
(CHEMBL4783234)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(N\N=C\c3ccccc3O)ncnc12
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47n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 1 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550959
PNG
(CHEMBL4754340)
Show SMILES Nc1c(C(O)=O)c(cn1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(Cl)cc1
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54n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550940
PNG
(CHEMBL4788893)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(N\N=C\c3ccccc3)ncnc12
PDB
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56n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550959
PNG
(CHEMBL4754340)
Show SMILES Nc1c(C(O)=O)c(cn1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(Cl)cc1
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57n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550950
PNG
(CHEMBL4793024)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c1nc[nH]c2=O
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57n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550943
PNG
(CHEMBL4779357)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(Nc3ccc(Cl)cc3)ncnc12
PDB
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58n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550944
PNG
(CHEMBL4794296)
Show SMILES COc1ccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)cc1
PDB
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66n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550949
PNG
(CHEMBL4761238)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(Cl)ncnc12
PDB
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67n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550952
PNG
(CHEMBL4740144)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(c(C#N)c1\N=C\c1ccc(cc1)[N+]([O-])=O)-c1ccc(Cl)cc1
PDB
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69n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550943
PNG
(CHEMBL4779357)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(Nc3ccc(Cl)cc3)ncnc12
PDB
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70n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550950
PNG
(CHEMBL4793024)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c1nc[nH]c2=O
PDB
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72n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550930
PNG
(CHEMBL4759336)
Show SMILES Cc1nc2n(cc(-c3ccc(Cl)cc3)c2c(=O)[nH]1)-c1ccc(cc1)S(N)(=O)=O
PDB
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72n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550954
PNG
(CHEMBL4744898)
Show SMILES COc1cc(\C=N\c2c(C#N)c(cn2-c2ccc(cc2)S(N)(=O)=O)-c2ccc(Cl)cc2)ccc1O
PDB
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72n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550953
PNG
(CHEMBL4745047)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(c(C#N)c1\N=C\c1cccc(c1)[N+]([O-])=O)-c1ccc(Cl)cc1
PDB
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74n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550959
PNG
(CHEMBL4754340)
Show SMILES Nc1c(C(O)=O)c(cn1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(Cl)cc1
PDB
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75n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550949
PNG
(CHEMBL4761238)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(Cl)ncnc12
PDB
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76n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550948
PNG
(CHEMBL4753308)
Show SMILES NNc1ncnc2n(cc(-c3ccc(Cl)cc3)c12)-c1ccc(cc1)S(N)(=O)=O
PDB
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79n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550941
PNG
(CHEMBL4782955)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(NCc3ccccc3)ncnc12
PDB
MMDB

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83n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50550944
PNG
(CHEMBL4794296)
Show SMILES COc1ccc(Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)cc1
PDB
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86n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 1 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50550948
PNG
(CHEMBL4753308)
Show SMILES NNc1ncnc2n(cc(-c3ccc(Cl)cc3)c12)-c1ccc(cc1)S(N)(=O)=O
PDB
MMDB

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86n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 9 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550941
PNG
(CHEMBL4782955)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(NCc3ccccc3)ncnc12
PDB
MMDB

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88n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550960
PNG
(CHEMBL4752780)
Show SMILES Nc1c(C#N)c(cn1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(Cl)cc1
PDB
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89n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550952
PNG
(CHEMBL4740144)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(c(C#N)c1\N=C\c1ccc(cc1)[N+]([O-])=O)-c1ccc(Cl)cc1
PDB
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90n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550930
PNG
(CHEMBL4759336)
Show SMILES Cc1nc2n(cc(-c3ccc(Cl)cc3)c2c(=O)[nH]1)-c1ccc(cc1)S(N)(=O)=O
PDB
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94n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50550940
PNG
(CHEMBL4788893)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c(N\N=C\c3ccccc3)ncnc12
PDB
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126n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 12 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50550959
PNG
(CHEMBL4754340)
Show SMILES Nc1c(C(O)=O)c(cn1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(Cl)cc1
PDB
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128n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 1 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550939
PNG
(CHEMBL4747589)
Show SMILES COc1ccc(\C=N\Nc2ncnc3n(cc(-c4ccc(Cl)cc4)c23)-c2ccc(cc2)S(N)(=O)=O)cc1
PDB
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128n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50550950
PNG
(CHEMBL4793024)
Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(-c2ccc(Cl)cc2)c2c1nc[nH]c2=O
PDB
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129n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human carbonic anhydrase 2 measured for 10 to 100 secs by phenol red-based stopped-flow CO2 hydration assay


Citation and Details

Article DOI: 10.1016/j.ejmech.2019.112021
BindingDB Entry DOI: 10.7270/Q2H135NB
More data for this
Ligand-Target Pair
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