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BDBM33273 azo-sulfonamide, 2b

SMILES: Nc1ccc(cc1)\N=N\c1cccc(c1)S(N)(=O)=O

InChI Key: InChIKey=VAOWCMBATGAWIO-FOCLMDBBSA-N

Data: 7 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 7 hits for monomerid = 33273   
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 9


(Homo sapiens (Human))
BDBM33273
PNG
(azo-sulfonamide, 2b)
Show SMILES Nc1ccc(cc1)\N=N\c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C12H12N4O2S/c13-9-4-6-10(7-5-9)15-16-11-2-1-3-12(8-11)19(14,17)18/h1-8H,13H2,(H2,14,17,18)/b16-15+
PDB
MMDB

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UniChem

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Article
PubMed
5.90n/an/an/an/an/an/an/an/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 17: 7093-9 (2009)


Article DOI: 10.1016/j.bmc.2009.09.003
BindingDB Entry DOI: 10.7270/Q2M32T4Q
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM33273
PNG
(azo-sulfonamide, 2b)
Show SMILES Nc1ccc(cc1)\N=N\c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C12H12N4O2S/c13-9-4-6-10(7-5-9)15-16-11-2-1-3-12(8-11)19(14,17)18/h1-8H,13H2,(H2,14,17,18)/b16-15+
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UniChem

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Article
PubMed
7.30n/an/an/an/an/an/an/an/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 17: 7093-9 (2009)


Article DOI: 10.1016/j.bmc.2009.09.003
BindingDB Entry DOI: 10.7270/Q2M32T4Q
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM33273
PNG
(azo-sulfonamide, 2b)
Show SMILES Nc1ccc(cc1)\N=N\c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C12H12N4O2S/c13-9-4-6-10(7-5-9)15-16-11-2-1-3-12(8-11)19(14,17)18/h1-8H,13H2,(H2,14,17,18)/b16-15+
PDB
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Article
PubMed
88n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human cloned full length carbonic anhydrase 2 by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4929-32 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.088
BindingDB Entry DOI: 10.7270/Q2H70GSS
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM33273
PNG
(azo-sulfonamide, 2b)
Show SMILES Nc1ccc(cc1)\N=N\c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C12H12N4O2S/c13-9-4-6-10(7-5-9)15-16-11-2-1-3-12(8-11)19(14,17)18/h1-8H,13H2,(H2,14,17,18)/b16-15+
PDB
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Reactome pathway
KEGG

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Article
PubMed
88 -9.62n/an/an/an/an/a7.425



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 17: 7093-9 (2009)


Article DOI: 10.1016/j.bmc.2009.09.003
BindingDB Entry DOI: 10.7270/Q2M32T4Q
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM33273
PNG
(azo-sulfonamide, 2b)
Show SMILES Nc1ccc(cc1)\N=N\c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C12H12N4O2S/c13-9-4-6-10(7-5-9)15-16-11-2-1-3-12(8-11)19(14,17)18/h1-8H,13H2,(H2,14,17,18)/b16-15+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

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UniChem

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Article
PubMed
96 -9.57n/an/an/an/an/a7.425



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 17: 7093-9 (2009)


Article DOI: 10.1016/j.bmc.2009.09.003
BindingDB Entry DOI: 10.7270/Q2M32T4Q
More data for this
Ligand-Target Pair
Carbonic Anhydrase (mtCA 1)


(Mycobacterium tuberculosis)
BDBM33273
PNG
(azo-sulfonamide, 2b)
Show SMILES Nc1ccc(cc1)\N=N\c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C12H12N4O2S/c13-9-4-6-10(7-5-9)15-16-11-2-1-3-12(8-11)19(14,17)18/h1-8H,13H2,(H2,14,17,18)/b16-15+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
7.00E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis recombinant carbonic anhydrase Rv1284 by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4929-32 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.088
BindingDB Entry DOI: 10.7270/Q2H70GSS
More data for this
Ligand-Target Pair
PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE)


(Mycobacterium tuberculosis)
BDBM33273
PNG
(azo-sulfonamide, 2b)
Show SMILES Nc1ccc(cc1)\N=N\c1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C12H12N4O2S/c13-9-4-6-10(7-5-9)15-16-11-2-1-3-12(8-11)19(14,17)18/h1-8H,13H2,(H2,14,17,18)/b16-15+
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
8.68E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis recombinant carbonic anhydrase Rv3273 by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4929-32 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.088
BindingDB Entry DOI: 10.7270/Q2H70GSS
More data for this
Ligand-Target Pair