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BDBM50339312 2-Amino-6-(5-oxo-5-(undecyloxy)pentanamido)heptanedioic Acid::CHEMBL1689710

SMILES: CCCCCCCCCCCOC(=O)CCCC(=O)NC(CCCC(N)C(O)=O)C(O)=O

InChI Key: InChIKey=CVOQTHOVGZJWLS-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50339312   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
nucleotide-binding oligomerization domain containing 1


(Homo sapiens (Human))
BDBM50339312
PNG
(2-Amino-6-(5-oxo-5-(undecyloxy)pentanamido)heptane...)
Show SMILES CCCCCCCCCCCOC(=O)CCCC(=O)NC(CCCC(N)C(O)=O)C(O)=O
Show InChI InChI=1S/C23H42N2O7/c1-2-3-4-5-6-7-8-9-10-17-32-21(27)16-12-15-20(26)25-19(23(30)31)14-11-13-18(24)22(28)29/h18-19H,2-17,24H2,1H3,(H,25,26)(H,28,29)(H,30,31)
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Similars

Article
PubMed
n/an/an/an/a 0.390n/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
Agonist activity at human NOD-1 expressed in human HEK293 cells assessed as NFkappaB induction by spectrophotometric analysis


J Med Chem 54: 1490-510 (2011)


Article DOI: 10.1021/jm101535e
BindingDB Entry DOI: 10.7270/Q2PV6KPQ
More data for this
Ligand-Target Pair