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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nitric Oxide Synthase, inducible' and Ligand = 'BDBM50357556'   
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
Nitric Oxide Synthase, inducible


(Mus musculus (mouse))
BDBM50357556
PNG
(CHEMBL1915173)
Show SMILES COC(=O)[C@H]1Cc2c(CN1C(=O)NC1CCCCC1)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C20H25N3O3/c1-26-19(24)18-11-15-14-9-5-6-10-16(14)22-17(15)12-23(18)20(25)21-13-7-3-2-4-8-13/h5-6,9-10,13,18,22H,2-4,7-8,11-12H2,1H3,(H,21,25)/t18-/m1/s1
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.16E+4n/an/an/an/an/an/a



University of Hawai'i at Hilo

Curated by ChEMBL


Assay Description
Inhibition of iNOS-mediated nitric oxide production in LPS-stimulated mouse RAW 264.7 cells pretreated 15 mins before LPS challenge measured after 20...


Bioorg Med Chem 19: 6182-95 (2011)


Article DOI: 10.1016/j.bmc.2011.09.020
BindingDB Entry DOI: 10.7270/Q2Z89CTS
More data for this
Ligand-Target Pair