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BDBM50137675 4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-benzenesulfonamide::CHEMBL308495::N-(p-sulfamoylphenyl)-alpha-glycopyranosylamine, 4::N-(p-sulfamoylphenyl)-alpha-glycopyranosylamine, 5::N-(p-sulfamoylphenyl)-alpha-glycopyranosylamine, 6

SMILES: NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1

InChI Key: InChIKey=FGIKBEHQPSXRFZ-UHFFFAOYSA-N

Data: 9 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 9 hits for monomerid = 50137675   
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 6 (CA-VI)


(Homo sapiens (Human))
BDBM50137675
PNG
(4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-be...)
Show SMILES NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1
Show InChI InChI=1S/C11H16N2O6S/c12-20(17,18)7-3-1-6(2-4-7)13-11-10(16)9(15)8(14)5-19-11/h1-4,8-11,13-16H,5H2,(H2,12,17,18)
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PC sid
UniChem
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PubMed
0.560 -12.4n/an/an/an/an/a7.520



Institut des Biomolécules Max Mousseron (IBMM)



Assay Description
Inhibition assay using carbonic anhydrases with an SX.18MV-R, a stopped-flow instrument from Applied Photophysics was used for assaying the CA cataly...


Chem Biol Drug Des 74: 636-9 (2009)


Article DOI: 10.1111/j.1747-0285.2009.00902.x
More data for this
Ligand-Target Pair
Carbonic anhydrase 6 (CA-VI)


(Homo sapiens (Human))
BDBM50137675
PNG
(4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-be...)
Show SMILES NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1
Show InChI InChI=1S/C11H16N2O6S/c12-20(17,18)7-3-1-6(2-4-7)13-11-10(16)9(15)8(14)5-19-11/h1-4,8-11,13-16H,5H2,(H2,12,17,18)
PDB

UniProtKB/SwissProt

antibodypedia
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
3.5 -11.3n/an/an/an/an/a7.520



Institut des Biomolécules Max Mousseron (IBMM)



Assay Description
Inhibition assay using carbonic anhydrases with an SX.18MV-R, a stopped-flow instrument from Applied Photophysics was used for assaying the CA cataly...


Chem Biol Drug Des 74: 636-9 (2009)


Article DOI: 10.1111/j.1747-0285.2009.00902.x
More data for this
Ligand-Target Pair
Carbonic anhydrase 6 (CA-VI)


(Homo sapiens (Human))
BDBM50137675
PNG
(4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-be...)
Show SMILES NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1
Show InChI InChI=1S/C11H16N2O6S/c12-20(17,18)7-3-1-6(2-4-7)13-11-10(16)9(15)8(14)5-19-11/h1-4,8-11,13-16H,5H2,(H2,12,17,18)
PDB

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antibodypedia
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PC sid
UniChem
Article
PubMed
5.10 -11.1n/an/an/an/an/a7.520



Institut des Biomolécules Max Mousseron (IBMM)



Assay Description
Inhibition assay using carbonic anhydrases with an SX.18MV-R, a stopped-flow instrument from Applied Photophysics was used for assaying the CA cataly...


Chem Biol Drug Des 74: 636-9 (2009)


Article DOI: 10.1111/j.1747-0285.2009.00902.x
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50137675
PNG
(4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-be...)
Show SMILES NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1
Show InChI InChI=1S/C11H16N2O6S/c12-20(17,18)7-3-1-6(2-4-7)13-11-10(16)9(15)8(14)5-19-11/h1-4,8-11,13-16H,5H2,(H2,12,17,18)
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12 -10.6n/an/an/an/an/a7.520



Institut des Biomolécules Max Mousseron (IBMM)



Assay Description
Inhibition assay using carbonic anhydrases with an SX.18MV-R, a stopped-flow instrument from Applied Photophysics was used for assaying the CA cataly...


Chem Biol Drug Des 74: 636-9 (2009)


Article DOI: 10.1111/j.1747-0285.2009.00902.x
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50137675
PNG
(4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-be...)
Show SMILES NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1
Show InChI InChI=1S/C11H16N2O6S/c12-20(17,18)7-3-1-6(2-4-7)13-11-10(16)9(15)8(14)5-19-11/h1-4,8-11,13-16H,5H2,(H2,12,17,18)
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15 -10.5n/an/an/an/an/a7.520



Institut des Biomolécules Max Mousseron (IBMM)



Assay Description
Inhibition assay using carbonic anhydrases with an SX.18MV-R, a stopped-flow instrument from Applied Photophysics was used for assaying the CA cataly...


Chem Biol Drug Des 74: 636-9 (2009)


Article DOI: 10.1111/j.1747-0285.2009.00902.x
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50137675
PNG
(4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-be...)
Show SMILES NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1
Show InChI InChI=1S/C11H16N2O6S/c12-20(17,18)7-3-1-6(2-4-7)13-11-10(16)9(15)8(14)5-19-11/h1-4,8-11,13-16H,5H2,(H2,12,17,18)
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16 -10.4n/an/an/an/an/a7.520



Institut des Biomolécules Max Mousseron (IBMM)



Assay Description
Inhibition assay using carbonic anhydrases with an SX.18MV-R, a stopped-flow instrument from Applied Photophysics was used for assaying the CA cataly...


Chem Biol Drug Des 74: 636-9 (2009)


Article DOI: 10.1111/j.1747-0285.2009.00902.x
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50137675
PNG
(4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-be...)
Show SMILES NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1
Show InChI InChI=1S/C11H16N2O6S/c12-20(17,18)7-3-1-6(2-4-7)13-11-10(16)9(15)8(14)5-19-11/h1-4,8-11,13-16H,5H2,(H2,12,17,18)
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630 -8.31n/an/an/an/an/a7.520



Institut des Biomolécules Max Mousseron (IBMM)



Assay Description
Inhibition assay using carbonic anhydrases with an SX.18MV-R, a stopped-flow instrument from Applied Photophysics was used for assaying the CA cataly...


Chem Biol Drug Des 74: 636-9 (2009)


Article DOI: 10.1111/j.1747-0285.2009.00902.x
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50137675
PNG
(4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-be...)
Show SMILES NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1
Show InChI InChI=1S/C11H16N2O6S/c12-20(17,18)7-3-1-6(2-4-7)13-11-10(16)9(15)8(14)5-19-11/h1-4,8-11,13-16H,5H2,(H2,12,17,18)
PDB
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NCI pathway
Reactome pathway
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750 -8.21n/an/an/an/an/a7.520



Institut des Biomolécules Max Mousseron (IBMM)



Assay Description
Inhibition assay using carbonic anhydrases with an SX.18MV-R, a stopped-flow instrument from Applied Photophysics was used for assaying the CA cataly...


Chem Biol Drug Des 74: 636-9 (2009)


Article DOI: 10.1111/j.1747-0285.2009.00902.x
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50137675
PNG
(4-(3,4,5-Trihydroxy-tetrahydro-pyran-2-ylamino)-be...)
Show SMILES NS(=O)(=O)c1ccc(NC2OCC(O)C(O)C2O)cc1
Show InChI InChI=1S/C11H16N2O6S/c12-20(17,18)7-3-1-6(2-4-7)13-11-10(16)9(15)8(14)5-19-11/h1-4,8-11,13-16H,5H2,(H2,12,17,18)
PDB
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UniChem
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PubMed
840 -8.14n/an/an/an/an/a7.520



Institut des Biomolécules Max Mousseron (IBMM)



Assay Description
Inhibition assay using carbonic anhydrases with an SX.18MV-R, a stopped-flow instrument from Applied Photophysics was used for assaying the CA cataly...


Chem Biol Drug Des 74: 636-9 (2009)


Article DOI: 10.1111/j.1747-0285.2009.00902.x
More data for this
Ligand-Target Pair