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SMILES: Cc1oc(=O)n(c1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(C)cc1

InChI Key: InChIKey=JAPKJIUHTVTGNM-UHFFFAOYSA-N

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 = 50084367   
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 2


(Homo sapiens (Human))
BDBM50084367
PNG
(4-(5-Methyl-2-oxo-3-p-tolyl-2,3-dihydro-oxazol-4-y...)
Show SMILES Cc1oc(=O)n(c1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(C)cc1
Show InChI InChI=1S/C17H16N2O4S/c1-11-3-7-14(8-4-11)19-16(12(2)23-17(19)20)13-5-9-15(10-6-13)24(18,21)22/h3-10H,1-2H3,(H2,18,21,22)
PDB
MMDB

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KEGG

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PubMed
n/an/a 1.70E+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
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50084367
PNG
(4-(5-Methyl-2-oxo-3-p-tolyl-2,3-dihydro-oxazol-4-y...)
Show SMILES Cc1oc(=O)n(c1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(C)cc1
Show InChI InChI=1S/C17H16N2O4S/c1-11-3-7-14(8-4-11)19-16(12(2)23-17(19)20)13-5-9-15(10-6-13)24(18,21)22/h3-10H,1-2H3,(H2,18,21,22)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 4.35E+4n/an/an/an/an/an/a



Jadavpur University

Curated by ChEMBL


Assay Description
Binding affinity towards Prostaglandin G/H synthase 1


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))
BDBM50084367
PNG
(4-(5-Methyl-2-oxo-3-p-tolyl-2,3-dihydro-oxazol-4-y...)
Show SMILES Cc1oc(=O)n(c1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(C)cc1
Show InChI InChI=1S/C17H16N2O4S/c1-11-3-7-14(8-4-11)19-16(12(2)23-17(19)20)13-5-9-15(10-6-13)24(18,21)22/h3-10H,1-2H3,(H2,18,21,22)
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 1.70E+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 1


(Homo sapiens (Human))
BDBM50084367
PNG
(4-(5-Methyl-2-oxo-3-p-tolyl-2,3-dihydro-oxazol-4-y...)
Show SMILES Cc1oc(=O)n(c1-c1ccc(cc1)S(N)(=O)=O)-c1ccc(C)cc1
Show InChI InChI=1S/C17H16N2O4S/c1-11-3-7-14(8-4-11)19-16(12(2)23-17(19)20)13-5-9-15(10-6-13)24(18,21)22/h3-10H,1-2H3,(H2,18,21,22)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 4.35E+4n/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