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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclooxygenase-1' and Monomerid = 50311371   
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
Cyclooxygenase-1 (COX-1)


(Homo sapiens (Human))
BDBM50311371
PNG
(CHEMBL1078091 | N-[3-(3-bromophenylamino)-4-pyridi...)
Show SMILES CS(=O)(=O)Nc1ccncc1Nc1cccc(Br)c1
Show InChI InChI=1S/C12H12BrN3O2S/c1-19(17,18)16-11-5-6-14-8-12(11)15-10-4-2-3-9(13)7-10/h2-8,15H,1H3,(H,14,16)
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



University of Liege

Curated by ChEMBL


Assay Description
Inhibition of COX1 in human whole blood assessed as TXB2 production by enzyme immunoassay


J Med Chem 52: 5864-71 (2009)


Article DOI: 10.1021/jm900702b
BindingDB Entry DOI: 10.7270/Q2CV4JQ6
More data for this
Ligand-Target Pair