BDBM50386752 CHEMBL2046887

SMILES CO[C@H]1\C=C\O[C@@]2(C)Oc3c(C2=O)c2c4nc5c(OCCCCN6CCN(CC6)C(=O)Cn6ccnc6)cccc5oc4c(NC(=O)C(C)=CC=C[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)c(=O)c2c(O)c3C

InChI Key InChIKey=JAQLNEWIOJRUDL-UHFFFAOYSA-N

Data  3 IC50  1 EC50

  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 = 50386752   

TargetNuclear receptor subfamily 1 group I member 2(Human)
University of Michigan

Curated by ChEMBL
LigandPNGBDBM50386752(CHEMBL2046887)
Affinity DataEC50:  5.50E+3nMAssay Description:Activation of PXR in human DPX2 cells after 24 hrs by luciferase reporter gene assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/7/2013
Entry Details Article
PubMed
TargetDNA-directed RNA polymerase subunit beta(Escherichia coli)
The Pennsylvania State University

Curated by ChEMBL
LigandPNGBDBM50386752(CHEMBL2046887)
Affinity DataIC50: 1.30E+4nMAssay Description:Inhibition of rifamycin-resistant Escherichia coli RNA polymerase S531L mutant after 10 mins by rolling circle transcription assay in presence of DNA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetDNA-directed RNA polymerase subunit beta(Escherichia coli)
The Pennsylvania State University

Curated by ChEMBL
LigandPNGBDBM50386752(CHEMBL2046887)
Affinity DataIC50: 1.58E+6nMAssay Description:Inhibition of rifamycin-resistant Escherichia coli RNA polymerase H526Y mutant after 10 mins by rolling circle transcription assay in presence of DNA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed
TargetDNA-directed RNA polymerase subunit beta(Escherichia coli)
The Pennsylvania State University

Curated by ChEMBL
LigandPNGBDBM50386752(CHEMBL2046887)
Affinity DataIC50: 4.10E+4nMAssay Description:Inhibition of rifamycin-resistant Escherichia coli RNA polymerase D516V mutant after 10 mins by rolling circle transcription assay in presence of DNA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/1/2020
Entry Details Article
PubMed