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BDBM50339445 6-Sulfamoyl-alpha,beta-D-galactopyranose::CHEMBL1688314

SMILES: NS(=O)(=O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O

InChI Key: InChIKey=PHTDYYFDBIUKPL-SVZMEOIVSA-N

Data: 4 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 4 hits for monomerid = 50339445   
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))
BDBM50339445
PNG
(6-Sulfamoyl-alpha,beta-D-galactopyranose | CHEMBL1...)
Show SMILES NS(=O)(=O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO8S/c7-16(12,13)14-1-2-3(8)4(9)5(10)6(11)15-2/h2-6,8-11H,1H2,(H2,7,12,13)/t2-,3+,4+,5-,6?/m1/s1
PDB
MMDB

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Article
PubMed
7.60n/an/an/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 catalytic domain by CO2 hydration assay


J Med Chem 54: 1481-9 (2011)

More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (human))
BDBM50339445
PNG
(6-Sulfamoyl-alpha,beta-D-galactopyranose | CHEMBL1...)
Show SMILES NS(=O)(=O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO8S/c7-16(12,13)14-1-2-3(8)4(9)5(10)6(11)15-2/h2-6,8-11H,1H2,(H2,7,12,13)/t2-,3+,4+,5-,6?/m1/s1
PDB
MMDB

NCI pathway
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KEGG

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antibodypedia
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CHEMBL
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Article
PubMed
62n/an/an/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 catalytic domain by CO2 hydration assay


J Med Chem 54: 1481-9 (2011)

More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM50339445
PNG
(6-Sulfamoyl-alpha,beta-D-galactopyranose | CHEMBL1...)
Show SMILES NS(=O)(=O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO8S/c7-16(12,13)14-1-2-3(8)4(9)5(10)6(11)15-2/h2-6,8-11H,1H2,(H2,7,12,13)/t2-,3+,4+,5-,6?/m1/s1
PDB
MMDB

Reactome pathway
KEGG

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antibodypedia
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Article
PubMed
93n/an/an/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 by CO2 hydration assay


J Med Chem 54: 1481-9 (2011)

More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (human))
BDBM50339445
PNG
(6-Sulfamoyl-alpha,beta-D-galactopyranose | CHEMBL1...)
Show SMILES NS(=O)(=O)OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C6H13NO8S/c7-16(12,13)14-1-2-3(8)4(9)5(10)6(11)15-2/h2-6,8-11H,1H2,(H2,7,12,13)/t2-,3+,4+,5-,6?/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.50E+3n/an/an/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 by CO2 hydration assay


J Med Chem 54: 1481-9 (2011)

More data for this
Ligand-Target Pair