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BDBM50200448 4-sulfamoyl-N-[1-((2S,3S,4R,5R)-3,4,5-trihydroxy-tetrahydro-pyran-2-yl)-1H-[1,2,3]triazol-4-ylmethyl]-benzamide::CHEMBL231896

SMILES: NS(=O)(=O)c1ccc(cc1)C(=O)NCc1cn(nn1)[C@H]1OC[C@@H](O)[C@@H](O)[C@@H]1O

InChI Key: InChIKey=FBBVGKUOXFKGAI-CXTNEJHOSA-N

Data: 2 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 2 hits for monomerid = 50200448   
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))
BDBM50200448
PNG
(4-sulfamoyl-N-[1-((2S,3S,4R,5R)-3,4,5-trihydroxy-t...)
Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1cn(nn1)[C@H]1OC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C15H19N5O7S/c16-28(25,26)10-3-1-8(2-4-10)14(24)17-5-9-6-20(19-18-9)15-13(23)12(22)11(21)7-27-15/h1-4,6,11-13,15,21-23H,5,7H2,(H,17,24)(H2,16,25,26)/t11-,12-,13+,15+/m1/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
11.5n/an/an/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CA12 by CO2 hydration assay


Bioorg Med Chem Lett 17: 987-92 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.046
BindingDB Entry DOI: 10.7270/Q2JD4XMG
More data for this
Ligand-Target Pair
Carbonic anhydrase 14


(Homo sapiens (Human))
BDBM50200448
PNG
(4-sulfamoyl-N-[1-((2S,3S,4R,5R)-3,4,5-trihydroxy-t...)
Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)NCc1cn(nn1)[C@H]1OC[C@@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C15H19N5O7S/c16-28(25,26)10-3-1-8(2-4-10)14(24)17-5-9-6-20(19-18-9)15-13(23)12(22)11(21)7-27-15/h1-4,6,11-13,15,21-23H,5,7H2,(H,17,24)(H2,16,25,26)/t11-,12-,13+,15+/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
101n/an/an/an/an/an/an/an/a



Griffith University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant CA14 by CO2 hydration assay


Bioorg Med Chem Lett 17: 987-92 (2007)


Article DOI: 10.1016/j.bmcl.2006.11.046
BindingDB Entry DOI: 10.7270/Q2JD4XMG
More data for this
Ligand-Target Pair