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BDBM91679 Pyrazolyl benzenesulfonamide derivative, 7b

SMILES: Cc1ccc(cc1)-c1nn(cc1C(N)=O)-c1ccc(cc1)S(N)(=O)=O

InChI Key: InChIKey=KQNLJPQBNLBZFU-UHFFFAOYSA-N

Data: 4 KI  2 IC50

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 6 hits for monomerid = 91679   
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


(Homo sapiens (Human))
BDBM91679
PNG
(Pyrazolyl benzenesulfonamide derivative, 7b)
Show SMILES Cc1ccc(cc1)-c1nn(cc1C(N)=O)-c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C17H16N4O3S/c1-11-2-4-12(5-3-11)16-15(17(18)22)10-21(20-16)13-6-8-14(9-7-13)25(19,23)24/h2-10H,1H3,(H2,18,22)(H2,19,23,24)
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3.10n/an/an/an/an/an/an/an/a



Kurukshetra University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12-mediated CO2 hydration preincubated for 10 mins by stopped-flow assay


Eur J Med Chem 76: 284-90 (2014)


Article DOI: 10.1016/j.ejmech.2014.02.023
BindingDB Entry DOI: 10.7270/Q2833W01
More data for this
Ligand-Target Pair
Carbonic anhydrases; II & IX


(Homo sapiens (Human))
BDBM91679
PNG
(Pyrazolyl benzenesulfonamide derivative, 7b)
Show SMILES Cc1ccc(cc1)-c1nn(cc1C(N)=O)-c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C17H16N4O3S/c1-11-2-4-12(5-3-11)16-15(17(18)22)10-21(20-16)13-6-8-14(9-7-13)25(19,23)24/h2-10H,1H3,(H2,18,22)(H2,19,23,24)
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4.20n/an/an/an/an/an/an/an/a



Kurukshetra University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9-mediated CO2 hydration preincubated for 10 mins by stopped-flow assay


Eur J Med Chem 76: 284-90 (2014)


Article DOI: 10.1016/j.ejmech.2014.02.023
BindingDB Entry DOI: 10.7270/Q2833W01
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM91679
PNG
(Pyrazolyl benzenesulfonamide derivative, 7b)
Show SMILES Cc1ccc(cc1)-c1nn(cc1C(N)=O)-c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C17H16N4O3S/c1-11-2-4-12(5-3-11)16-15(17(18)22)10-21(20-16)13-6-8-14(9-7-13)25(19,23)24/h2-10H,1H3,(H2,18,22)(H2,19,23,24)
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5.60n/an/an/an/an/an/an/an/a



Kurukshetra University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2-mediated CO2 hydration preincubated for 10 mins by stopped-flow assay


Eur J Med Chem 76: 284-90 (2014)


Article DOI: 10.1016/j.ejmech.2014.02.023
BindingDB Entry DOI: 10.7270/Q2833W01
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (Human))
BDBM91679
PNG
(Pyrazolyl benzenesulfonamide derivative, 7b)
Show SMILES Cc1ccc(cc1)-c1nn(cc1C(N)=O)-c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C17H16N4O3S/c1-11-2-4-12(5-3-11)16-15(17(18)22)10-21(20-16)13-6-8-14(9-7-13)25(19,23)24/h2-10H,1H3,(H2,18,22)(H2,19,23,24)
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68n/an/an/an/an/an/an/an/a



Kurukshetra University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1-mediated CO2 hydration preincubated for 10 mins by stopped-flow assay


Eur J Med Chem 76: 284-90 (2014)


Article DOI: 10.1016/j.ejmech.2014.02.023
BindingDB Entry DOI: 10.7270/Q2833W01
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (Human))
BDBM91679
PNG
(Pyrazolyl benzenesulfonamide derivative, 7b)
Show SMILES Cc1ccc(cc1)-c1nn(cc1C(N)=O)-c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C17H16N4O3S/c1-11-2-4-12(5-3-11)16-15(17(18)22)10-21(20-16)13-6-8-14(9-7-13)25(19,23)24/h2-10H,1H3,(H2,18,22)(H2,19,23,24)
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PubMed
n/an/a 1.26E+3n/an/an/an/an/an/a



University of Alexandria



Assay Description
The compounds that exhibited potent anti-inflammatory profiles were futher tested for their ability to inhibit human COX-1 and COX-2 enzymes in-vitro...


J Enzyme Inhib Med Chem 24: 296-309 (2009)


Article DOI: 10.1080/14756360802188404
BindingDB Entry DOI: 10.7270/Q2S1813W
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (Human))
BDBM91679
PNG
(Pyrazolyl benzenesulfonamide derivative, 7b)
Show SMILES Cc1ccc(cc1)-c1nn(cc1C(N)=O)-c1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C17H16N4O3S/c1-11-2-4-12(5-3-11)16-15(17(18)22)10-21(20-16)13-6-8-14(9-7-13)25(19,23)24/h2-10H,1H3,(H2,18,22)(H2,19,23,24)
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n/an/a 7.64E+4n/an/an/an/an/an/a



University of Alexandria



Assay Description
The compounds that exhibited potent anti-inflammatory profiles were futher tested for their ability to inhibit human COX-1 and COX-2 enzymes in-vitro...


J Enzyme Inhib Med Chem 24: 296-309 (2009)


Article DOI: 10.1080/14756360802188404
BindingDB Entry DOI: 10.7270/Q2S1813W
More data for this
Ligand-Target Pair