Found 4 hits Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50373527' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373527
(CHEMBL271338)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cccs2)cc(n1)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S2/c1-27(24,25)13-6-4-11(5-7-13)16-22-14(17(18,19)20)9-15(23-16)21-10-12-3-2-8-26-12/h2-9H,10H2,1H3,(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Faes Farma S.A.
Curated by ChEMBL
| Assay Description
Inhibition of human COX2 in human whole blood |
Bioorg Med Chem 16: 2183-99 (2008)
Article DOI: 10.1016/j.bmc.2007.11.079
BindingDB Entry DOI: 10.7270/Q2GX4CDQ |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373527
(CHEMBL271338)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cccs2)cc(n1)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S2/c1-27(24,25)13-6-4-11(5-7-13)16-22-14(17(18,19)20)9-15(23-16)21-10-12-3-2-8-26-12/h2-9H,10H2,1H3,(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 22.4 | n/a | n/a | n/a | n/a | n/a | n/a |
Faes Farma S.A.
Curated by ChEMBL
| Assay Description
Inhibition of human COX2 |
Bioorg Med Chem 16: 2183-99 (2008)
Article DOI: 10.1016/j.bmc.2007.11.079
BindingDB Entry DOI: 10.7270/Q2GX4CDQ |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373527
(CHEMBL271338)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cccs2)cc(n1)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S2/c1-27(24,25)13-6-4-11(5-7-13)16-22-14(17(18,19)20)9-15(23-16)21-10-12-3-2-8-26-12/h2-9H,10H2,1H3,(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 4.76E+8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50373527
(CHEMBL271338)Show SMILES CS(=O)(=O)c1ccc(cc1)-c1nc(NCc2cccs2)cc(n1)C(F)(F)F Show InChI InChI=1S/C17H14F3N3O2S2/c1-27(24,25)13-6-4-11(5-7-13)16-22-14(17(18,19)20)9-15(23-16)21-10-12-3-2-8-26-12/h2-9H,10H2,1H3,(H,21,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
| n/a | n/a | 4.76E+8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of COX2 in Homo sapiens (human) whole blood |
Citation and Details
Article DOI: 10.1007/s00044-011-9566-8
BindingDB Entry DOI: 10.7270/Q2Q81GZM |
More data for this
Ligand-Target Pair | |
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