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BDBM22974 2-[(2,6-dichloro-3-methylphenyl)amino]-N-(2-hydroxyethyl)benzamide::CHEMBL146854::Meclofenamic acid derivative, 26

SMILES: Cc1ccc(Cl)c(Nc2ccccc2C(=O)NCCO)c1Cl

InChI Key: InChIKey=YBHLBHNOYSSMNT-UHFFFAOYSA-N

Data: 4 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 22974   
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 (cyclooxygenase)


(Ovis aries (Sheep))
BDBM22974
PNG
(2-[(2,6-dichloro-3-methylphenyl)amino]-N-(2-hydrox...)
Show SMILES Cc1ccc(Cl)c(Nc2ccccc2C(=O)NCCO)c1Cl
Show InChI InChI=1S/C16H16Cl2N2O2/c1-10-6-7-12(17)15(14(10)18)20-13-5-3-2-4-11(13)16(22)19-8-9-21/h2-7,20-21H,8-9H2,1H3,(H,19,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 900n/an/an/an/a8.037



Vanderbilt University School of Medicine



Assay Description
For the time-dependent inhibition studies, COX enzyme was incubated with test compounds for 20 min and then analyzed for remaining COX activity by tr...


Proc Natl Acad Sci U S A 97: 925-30 (2000)


Article DOI: 10.1073/pnas.97.2.925
BindingDB Entry DOI: 10.7270/Q2XP736G
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (Human))
BDBM22974
PNG
(2-[(2,6-dichloro-3-methylphenyl)amino]-N-(2-hydrox...)
Show SMILES Cc1ccc(Cl)c(Nc2ccccc2C(=O)NCCO)c1Cl
Show InChI InChI=1S/C16H16Cl2N2O2/c1-10-6-7-12(17)15(14(10)18)20-13-5-3-2-4-11(13)16(22)19-8-9-21/h2-7,20-21H,8-9H2,1H3,(H,19,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Vanderbilt University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of the human Prostaglandin G/H synthase 2 was determined by thin-layer chromatography assay


Bioorg Med Chem Lett 12: 521-4 (2002)


BindingDB Entry DOI: 10.7270/Q2BP0247
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM22974
PNG
(2-[(2,6-dichloro-3-methylphenyl)amino]-N-(2-hydrox...)
Show SMILES Cc1ccc(Cl)c(Nc2ccccc2C(=O)NCCO)c1Cl
Show InChI InChI=1S/C16H16Cl2N2O2/c1-10-6-7-12(17)15(14(10)18)20-13-5-3-2-4-11(13)16(22)19-8-9-21/h2-7,20-21H,8-9H2,1H3,(H,19,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 600n/an/an/an/an/an/a



Vanderbilt University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of the ovine Prostaglandin G/H synthase 1 was determined by thin-layer chromatography assay


Bioorg Med Chem Lett 12: 521-4 (2002)


BindingDB Entry DOI: 10.7270/Q2BP0247
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (Human))
BDBM22974
PNG
(2-[(2,6-dichloro-3-methylphenyl)amino]-N-(2-hydrox...)
Show SMILES Cc1ccc(Cl)c(Nc2ccccc2C(=O)NCCO)c1Cl
Show InChI InChI=1S/C16H16Cl2N2O2/c1-10-6-7-12(17)15(14(10)18)20-13-5-3-2-4-11(13)16(22)19-8-9-21/h2-7,20-21H,8-9H2,1H3,(H,19,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 600n/an/an/an/an/a37



Vanderbilt University School of Medicine



Assay Description
For the time-dependent inhibition studies, COX enzyme was incubated with test compounds for 20 min and then analyzed for remaining COX activity by tr...


Proc Natl Acad Sci U S A 97: 925-30 (2000)


Article DOI: 10.1073/pnas.97.2.925
BindingDB Entry DOI: 10.7270/Q2XP736G
More data for this
Ligand-Target Pair