BDBM50596272 CHEMBL5199813

SMILES COc1ccc2ncc(F)c(CCCN3CCN(C\C=C\c4ccccc4)C[C@@H]3C(O)=O)c2c1

InChI Key InChIKey=PTUWCOMLTLLKMO-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50596272   

TargetPotassium voltage-gated channel subfamily H member 2(Human)
Technical University of Denmark

Curated by ChEMBL
LigandPNGBDBM50596272(CHEMBL5199813)
Affinity DataEC50:  3.80E+4nMAssay Description:Inhibition of hERG by fluorescence polarization assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/22/2023
Entry Details
PubMed
TargetDNA gyrase subunit A/B(Staphylococcus aureus)
Technical University of Denmark

Curated by ChEMBL
LigandPNGBDBM50596272(CHEMBL5199813)
Affinity DataIC50: 190nMAssay Description:Inhibition of Staphylococcus aureus DNA gyrase supercoiling activity using pNO1 plasmid DNA as substrate incubated for 30 mins by fluorescence based ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/22/2023
Entry Details
PubMed
TargetDNA topoisomerase 4 subunit A/B(Staphylococcus aureus)
Technical University of Denmark

Curated by ChEMBL
LigandPNGBDBM50596272(CHEMBL5199813)
Affinity DataIC50: 3.36E+3nMAssay Description:Inhibition of Staphylococcus aureus topoisomerase 4 using pNO1 plasmid DNA as substrate incubated for 30 mins by fluorescence based microtiter plate ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/22/2023
Entry Details
PubMed