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SMILES: CS(=O)(=O)c1ccc(cc1)-c1coc(=O)n1-c1ccc(cc1)C(F)(F)F

InChI Key: InChIKey=GSLFTGUVNZMGIF-UHFFFAOYSA-N

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50084343   
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
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50084343
PNG
(4-(4-Methanesulfonyl-phenyl)-3-(4-trifluoromethyl-...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1coc(=O)n1-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H12F3NO4S/c1-26(23,24)14-8-2-11(3-9-14)15-10-25-16(22)21(15)13-6-4-12(5-7-13)17(18,19)20/h2-10H,1H3
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PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against prostaglandin G/H synthase 1


J Med Chem 43: 214-23 (2000)


BindingDB Entry DOI: 10.7270/Q2DV1KK0
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50084343
PNG
(4-(4-Methanesulfonyl-phenyl)-3-(4-trifluoromethyl-...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1coc(=O)n1-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H12F3NO4S/c1-26(23,24)14-8-2-11(3-9-14)15-10-25-16(22)21(15)13-6-4-12(5-7-13)17(18,19)20/h2-10H,1H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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antibodypedia
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CHEMBL
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UniChem

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PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Jadavpur University

Curated by ChEMBL


Assay Description
Binding affinity towards Prostaglandin G/H synthase 2


Bioorg Med Chem Lett 13: 3753-7 (2003)


BindingDB Entry DOI: 10.7270/Q2JM2BS0
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50084343
PNG
(4-(4-Methanesulfonyl-phenyl)-3-(4-trifluoromethyl-...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1coc(=O)n1-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H12F3NO4S/c1-26(23,24)14-8-2-11(3-9-14)15-10-25-16(22)21(15)13-6-4-12(5-7-13)17(18,19)20/h2-10H,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents


Similars

PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Inhibitory activity against prostaglandin G/H synthase 2


J Med Chem 43: 214-23 (2000)


BindingDB Entry DOI: 10.7270/Q2DV1KK0
More data for this
Ligand-Target Pair