BDBM113770 NS2028 (1)

SMILES c1cc2c(cc1Br)N3C(=NOC3=O)CO2

InChI Key InChIKey=MUDRLQRJCGJJTB-UHFFFAOYSA-N

Data  3 IC50

PDB links: 1 PDB ID matches this monomer.

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 113770   

TargetAcyl-homoserine lactone acylase PvdQ [A190E,F674L](Pseudomonas aeruginosa)
The Broad Institute , Cambridge, Massachusetts 02142, United States

LigandPNGBDBM113770(NS2028 (1))
Affinity DataIC50: 1.30E+5nMAssay Description:The assay was performed with nine compound concentrations that ranged from 3 nM to 19.5 µM with PvdQ concentration of 20 nM. The positive contro...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/7/2014
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetAcyl-homoserine lactone acylase PvdQ(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
Helmholtz Institute For Pharmaceutical Research Saarland (HIPS)

Curated by ChEMBL
LigandPNGBDBM113770(NS2028 (1))
Affinity DataIC50: 6.50E+4nMAssay Description:Inhibition of Pseudomonas aeruginosa ATCC 15692 pvdQMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/22/2024
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetAcyl-homoserine lactone acylase PvdQ(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
Helmholtz Institute For Pharmaceutical Research Saarland (HIPS)

Curated by ChEMBL
LigandPNGBDBM113770(NS2028 (1))
Affinity DataIC50: 20nMAssay Description:Inhibition of Pseudomonas aeruginosa ATCC 15692 pvdQ incubated for 4 hrsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/22/2024
Entry Details
PubMedPDB3D3D Structure (crystal)