BDBM50271715 CHEMBL4125701

SMILES [H][C@@]12CC(=O)O[C@]1([H])C1=C([C@@H](CCc3ccccc3)O2)C(=O)C=CC1=O

InChI Key InChIKey=ALXJHNYHJQEHBV-CLCXKQKWSA-N

Data  2 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50271715   

TargetSortase family protein(Staphylococcus aureus)
Shanghai Institute Of Materia Medica

Curated by ChEMBL
LigandPNGBDBM50271715(CHEMBL4125701)
Affinity DataKi:  3.57E+3nMAssay Description:Irreversible inhibition of Staphylococcus aureus SrtA deltaN24 mutant transpeptidation activity using abz-LPATG-dnp as substrate incubated for 5 to 2...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSortase family protein(Staphylococcus aureus)
Shanghai Institute Of Materia Medica

Curated by ChEMBL
LigandPNGBDBM50271715(CHEMBL4125701)
Affinity DataKi:  3.57E+3nMAssay Description:Inhibition of SiaTnTRI2-induced activation of CD69 high in human lymphocytes assessed as InsP3 productionMore data for this Ligand-Target Pair
In DepthDetails PubMed
TargetSortase family protein(Staphylococcus aureus)
Shanghai Institute Of Materia Medica

Curated by ChEMBL
LigandPNGBDBM50271715(CHEMBL4125701)
Affinity DataIC50:  6.20E+3nMAssay Description:Inhibition of Staphylococcus aureus SrtA deltaN24 mutant transpeptidation activity using abz-LPATG-dnp as substrate preincubated for 10 mins followed...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetSortase family protein(Staphylococcus aureus)
Shanghai Institute Of Materia Medica

Curated by ChEMBL
LigandPNGBDBM50271715(CHEMBL4125701)
Affinity DataIC50:  1.00E+4nMAssay Description:Inhibition of Staphylococcus aureus SrtA deltaN24 mutant assessed as decrease in transpeptidation of IsdA (64 to 323 residues) incubated for 1.25 hrs...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed