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BDBM50465704 CHEMBL4282406

SMILES: CCCCCCCOc1ccc(cc1)C(=O)N[C@H]1CCOC1=O

InChI Key: InChIKey=MIQOJRRMMZMEPQ-INIZCTEOSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50465704   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Transcriptional activator protein lasR


(Pseudomonas aeruginosa)
BDBM50465704
PNG
(CHEMBL4282406)
Show SMILES CCCCCCCOc1ccc(cc1)C(=O)N[C@H]1CCOC1=O |r|
Show InChI InChI=1S/C18H25NO4/c1-2-3-4-5-6-12-22-15-9-7-14(8-10-15)17(20)19-16-11-13-23-18(16)21/h7-10,16H,2-6,11-13H2,1H3,(H,19,20)/t16-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



University of Nottingham

Curated by ChEMBL


Assay Description
Antagonist activity at Pseudomonas aeruginosa LasR expressed in Escherichia coli DH5alpha assessed as inhibition of protein interaction with OdDHL af...


J Med Chem 61: 10385-10402 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00540
BindingDB Entry DOI: 10.7270/Q2XP77NZ
More data for this
Ligand-Target Pair