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SMILES: COc1cccc2c(cn(C)c12)S(=O)(=O)NC(=O)Nc1ncc(Br)s1

InChI Key: InChIKey=UYENKFIAVMJNOD-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50305575   
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
Fructose-1,6-bisphosphatase 1


(Mus musculus)
BDBM50305575
PNG
(CHEMBL590113 | N-(5-bromothiazol-2-ylcarbamoyl)-7-...)
Show SMILES COc1cccc2c(cn(C)c12)S(=O)(=O)NC(=O)Nc1ncc(Br)s1
Show InChI InChI=1S/C14H13BrN4O4S2/c1-19-7-10(8-4-3-5-9(23-2)12(8)19)25(21,22)18-13(20)17-14-16-6-11(15)24-14/h3-7H,1-2H3,(H2,16,17,18,20)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.40E+4n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of FBPase in mouse liver


Bioorg Med Chem Lett 20: 594-9 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.093
BindingDB Entry DOI: 10.7270/Q27H1JPX
More data for this
Ligand-Target Pair
Fructose-1,6-bisphosphatase 1


(Homo sapiens (Human))
BDBM50305575
PNG
(CHEMBL590113 | N-(5-bromothiazol-2-ylcarbamoyl)-7-...)
Show SMILES COc1cccc2c(cn(C)c12)S(=O)(=O)NC(=O)Nc1ncc(Br)s1
Show InChI InChI=1S/C14H13BrN4O4S2/c1-19-7-10(8-4-3-5-9(23-2)12(8)19)25(21,22)18-13(20)17-14-16-6-11(15)24-14/h3-7H,1-2H3,(H2,16,17,18,20)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 70n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibition of FBPase in human liver


Bioorg Med Chem Lett 20: 594-9 (2010)


Article DOI: 10.1016/j.bmcl.2009.11.093
BindingDB Entry DOI: 10.7270/Q27H1JPX
More data for this
Ligand-Target Pair