BDBM50181523 CHEMBL3819281

SMILES c1cc(c(cc1C#N)F)CSc2[nH]c3c(n2)C(=O)NC(=N3)N

InChI Key InChIKey=GEUVDHJEINQZML-UHFFFAOYSA-N

Data  2 Kd

PDB links: 2 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
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50181523   

Target2-amino-4-hydroxy-6-hydroxymethyldihydropteridine diphosphokinase(Staphylococcus aureus)
Monash University

Curated by ChEMBL
LigandPNGBDBM50181523(CHEMBL3819281)
Affinity DataKd:  590nMAssay Description:Binding affinity to biotinylated Staphylococcus aureus HPPK in presence of 1 mM ATP by SPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2017
Entry Details Article
PubMedPDB3D3D Structure (crystal)
Target2-amino-4-hydroxy-6-hydroxymethyldihydropteridine pyrophosphokinase(Escherichia coli (strain K12))
Monash University

Curated by ChEMBL
LigandPNGBDBM50181523(CHEMBL3819281)
Affinity DataKd:  2.70E+3nMAssay Description:Binding affinity to biotinylated Escherichia coli HPPK expressed in Escherichia coli BL21 (DE3) in presence of 1 mM ATP by SPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
9/24/2017
Entry Details Article
PubMedPDB3D3D Structure (crystal)