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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'NACHT, LRR and PYD domains-containing protein 3' and Ligand = 'BDBM50199868'   
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
NACHT, LRR and PYD domains-containing protein 3


(Homo sapiens (Human))
BDBM50199868
PNG
(CHEMBL3906283)
Show SMILES CC(C)(O)c1coc(c1)S(=O)(=O)NC(=O)Nc1c2CCCc2cc2[C@@H](O)CCc12 |r|
Show InChI InChI=1S/C20H24N2O6S/c1-20(2,25)12-9-17(28-10-12)29(26,27)22-19(24)21-18-13-5-3-4-11(13)8-15-14(18)6-7-16(15)23/h8-10,16,23,25H,3-7H2,1-2H3,(H2,21,22,24)/t16-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.35E+3n/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of NLRP3 inflammasome in LPS-stimulated human monocyte derived macrophages assessed as reduction in NLRP3 inflammasome-induced IL-1beta pr...


ACS Med Chem Lett 7: 1034-1038 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00198
BindingDB Entry DOI: 10.7270/Q2HD7XKV
More data for this
Ligand-Target Pair