BDBM231665 1-(3-(4-(Pyridin-2-yl)piperazin-1-ylsulfonyl)phenyl)-3-(thiazol-2-yl)urea (1a)

SMILES c1ccnc(c1)N2CCN(CC2)S(=O)(=O)c3cccc(c3)NC(=O)Nc4nccs4

InChI Key InChIKey=NJPVZSIGDRLLTD-UHFFFAOYSA-N

Data  2 IC50

PDB links: 3 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 231665   

TargetPhenylalanine--tRNA ligase alpha/beta subunit(Escherichia coli (strain K12))
Astrazeneca R&D Boston

LigandPNGBDBM231665(1-(3-(4-(Pyridin-2-yl)piperazin-1-ylsulfonyl)pheny...)
Affinity DataIC50: 2.70nMpH: 8.0Assay Description:Compounds were solubilized in DMSO. Serial 2-fold dilutions covering two concentration ranges, 10 mM to 19.5 μM and 100 μM to 195 nM, were ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/9/2017
Entry Details Article
PubMed
TargetPhenylalanine--tRNA ligase alpha/beta subunit(Pseudomonas aeruginosa)
Astrazeneca R&D Boston

LigandPNGBDBM231665(1-(3-(4-(Pyridin-2-yl)piperazin-1-ylsulfonyl)pheny...)
Affinity DataIC50: 22nMpH: 8.0Assay Description:Compounds were solubilized in DMSO. Serial 2-fold dilutions covering two concentration ranges, 10 mM to 19.5 μM and 100 μM to 195 nM, were ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/9/2017
Entry Details Article
PubMedPDB3D3D Structure (crystal)