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SMILES: Cc1ccc(cc1)S(=O)(=O)NC(=O)NNC(=O)c1cc(c(Cl)cc1Cl)S(N)(=O)=O

InChI Key: InChIKey=DOZNSHKNXZSNGP-UHFFFAOYSA-N

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 4 hits for monomerid = 50019539   
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 12


(Homo sapiens (Human))
BDBM50019539
PNG
(CHEMBL3291107)
Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)NNC(=O)c1cc(c(Cl)cc1Cl)S(N)(=O)=O
Show InChI InChI=1S/C15H14Cl2N4O6S2/c1-8-2-4-9(5-3-8)29(26,27)21-15(23)20-19-14(22)10-6-13(28(18,24)25)12(17)7-11(10)16/h2-7H,1H3,(H,19,22)(H2,18,24,25)(H2,20,21,23)
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8.40n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Inhibition of human cloned transmembrane tumor-associated catalytic domain of carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydr...


Eur J Med Chem 82: 47-55 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.039
BindingDB Entry DOI: 10.7270/Q2X63PH6
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50019539
PNG
(CHEMBL3291107)
Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)NNC(=O)c1cc(c(Cl)cc1Cl)S(N)(=O)=O
Show InChI InChI=1S/C15H14Cl2N4O6S2/c1-8-2-4-9(5-3-8)29(26,27)21-15(23)20-19-14(22)10-6-13(28(18,24)25)12(17)7-11(10)16/h2-7H,1H3,(H,19,22)(H2,18,24,25)(H2,20,21,23)
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15n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


Assay Description
Inhibition of human cloned transmembrane tumor-associated catalytic domain of carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydra...


Eur J Med Chem 82: 47-55 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.039
BindingDB Entry DOI: 10.7270/Q2X63PH6
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50019539
PNG
(CHEMBL3291107)
Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)NNC(=O)c1cc(c(Cl)cc1Cl)S(N)(=O)=O
Show InChI InChI=1S/C15H14Cl2N4O6S2/c1-8-2-4-9(5-3-8)29(26,27)21-15(23)20-19-14(22)10-6-13(28(18,24)25)12(17)7-11(10)16/h2-7H,1H3,(H,19,22)(H2,18,24,25)(H2,20,21,23)
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63n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


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


Eur J Med Chem 82: 47-55 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.039
BindingDB Entry DOI: 10.7270/Q2X63PH6
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50019539
PNG
(CHEMBL3291107)
Show SMILES Cc1ccc(cc1)S(=O)(=O)NC(=O)NNC(=O)c1cc(c(Cl)cc1Cl)S(N)(=O)=O
Show InChI InChI=1S/C15H14Cl2N4O6S2/c1-8-2-4-9(5-3-8)29(26,27)21-15(23)20-19-14(22)10-6-13(28(18,24)25)12(17)7-11(10)16/h2-7H,1H3,(H,19,22)(H2,18,24,25)(H2,20,21,23)
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7.20E+3n/an/an/an/an/an/an/an/a



Medical University of Gdansk

Curated by ChEMBL


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


Eur J Med Chem 82: 47-55 (2014)


Article DOI: 10.1016/j.ejmech.2014.05.039
BindingDB Entry DOI: 10.7270/Q2X63PH6
More data for this
Ligand-Target Pair