BDBM50226670 CHEMBL251055::jatrorrhizine

SMILES COc1cc-2c(CC[n+]3cc4c(OC)c(OC)ccc4cc-23)cc1O

InChI Key InChIKey=MXTLAHSTUOXGQF-UHFFFAOYSA-O

Data  6 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 6 hits for monomerid = 50226670   

TargetNeuraminidase(Influenza A virus (strain A/USSR/90/1977 H1N1))
Chungnam National University

Curated by ChEMBL
LigandPNGBDBM50226670(jatrorrhizine | CHEMBL251055)
Affinity DataIC50: 6.62E+4nMAssay Description:Inhibition of recombinant Influenza A virus H1N1 neuraminidase using 4-methylumbelliferyl-alpha-D-Nacetylneuraminic acid sodium salt hydrate as subst...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/10/2016
Entry Details Article
PubMed
TargetNeuraminidase(Influenza A virus (strain A/USSR/90/1977 H1N1))
Chungnam National University

Curated by ChEMBL
LigandPNGBDBM50226670(jatrorrhizine | CHEMBL251055)
Affinity DataIC50: 7.63E+4nMAssay Description:Inhibition of Influenza A virus H5N1 neuraminidase using 4-methylumbelliferyl-alpha-D-Nacetylneuraminic acid sodium salt hydrate as substrate by fluo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/10/2016
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
National Cheng Kung University

Curated by ChEMBL
LigandPNGBDBM50226670(jatrorrhizine | CHEMBL251055)
Affinity DataIC50: 2.10E+3nMAssay Description:Inhibition of human CYP3A4 expressed in Escherichia coli assessed as inhibition of nifedipine oxidationMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/11/2009
Entry Details Article
PubMed
TargetReverse transcriptase(Human immunodeficiency virus type 1)
University of Illinois

Curated by ChEMBL
LigandPNGBDBM50226670(jatrorrhizine | CHEMBL251055)
Affinity DataIC50: 2.09E+5nMAssay Description:Inhibition of HIV1 RTMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2020
Entry Details Article
PubMed
TargetReverse transcriptase(Human immunodeficiency virus type 1)
University of Illinois

Curated by ChEMBL
LigandPNGBDBM50226670(jatrorrhizine | CHEMBL251055)
Affinity DataIC50: 2.09E+5nMAssay Description:Inhibition of Human immunodeficiency virus 1 NL4.3 reverse transcriptase activityMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/29/2020
Entry Details Article
PubMed
TargetLysine-specific histone demethylase 1A(Human)
Beijing University of Chinese Medicine

Curated by ChEMBL
LigandPNGBDBM50226670(jatrorrhizine | CHEMBL251055)
Affinity DataIC50: 1.55E+3nMAssay Description:Inhibition of recombinant LSD1 (unknown origin) expressed in Escherichia coli BL21 using H3K4me2 as substrate preincubated for 10 mins followed by su...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/18/2023
Entry Details
PubMed