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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin G/H synthase 2' and Ligand = 'BDBM50015569'   
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))
BDBM50015569
PNG
(CHEMBL1242276)
Show SMILES Clc1ccc(cc1)-c1nn(cc1-c1nnc(o1)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C23H15ClN4O/c24-18-13-11-16(12-14-18)21-20(15-28(27-21)19-9-5-2-6-10-19)23-26-25-22(29-23)17-7-3-1-4-8-17/h1-15H
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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DrugBank
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GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 4.70E+3n/an/an/an/an/an/a



Shoolini University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant COX2 after 2 mins by EIA


Eur J Med Chem 80: 167-74 (2014)


Article DOI: 10.1016/j.ejmech.2014.04.045
BindingDB Entry DOI: 10.7270/Q2T43VNF
More data for this
Ligand-Target Pair