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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50131627   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Prostaglandin G/H synthase 2


(Homo sapiens (Human))
BDBM50131627
PNG
(4-Chloro-5-(4-chloro-phenyl)-1-(4-methanesulfonyl-...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-n1cnc(Cl)c1-c1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O2S/c1-23(21,22)14-8-6-13(7-9-14)20-10-19-16(18)15(20)11-2-4-12(17)5-3-11/h2-10H,1H3
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/an/a 18n/an/an/an/an/an/a



Domp&egrove; pha.r.ma s.p.a.

Curated by ChEMBL


Assay Description
In vitro percent inhibition of Prostaglandin G/H synthase 2 (COX-2) in human whole blood was determined


J Med Chem 46: 3463-75 (2003)


Article DOI: 10.1021/jm030765s
BindingDB Entry DOI: 10.7270/Q2HQ3Z98
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase 1


(Homo sapiens (Human))
BDBM50131627
PNG
(4-Chloro-5-(4-chloro-phenyl)-1-(4-methanesulfonyl-...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-n1cnc(Cl)c1-c1ccc(Cl)cc1
Show InChI InChI=1S/C16H12Cl2N2O2S/c1-23(21,22)14-8-6-13(7-9-14)20-10-19-16(18)15(20)11-2-4-12(17)5-3-11/h2-10H,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Domp&egrove; pha.r.ma s.p.a.

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human Prostaglandin G/H synthase 1 (COX-1) in U-937 cells


J Med Chem 46: 3463-75 (2003)


Article DOI: 10.1021/jm030765s
BindingDB Entry DOI: 10.7270/Q2HQ3Z98
More data for this
Ligand-Target Pair