BDBM50441633 4-Hydroxyisocordoin::ISOBAVACHALCONE::Isobacachalcone::Isobavachalcone (3)

SMILES [#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])cc2)c1-[#8]

InChI Key InChIKey=DUWPGRAKHMEPCM-IZZDOVSWSA-N

Data  2 KI  3 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 = 50441633   

TargetReplicase polyprotein 1a(Human SARS coronavirus (SARS-CoV))
Gyeongsang National University

LigandPNGBDBM50441633(4-Hydroxyisocordoin | ISOBAVACHALCONE | Isobacacha...)
Affinity DataKi:  4.90E+3nM IC50:  7.30E+3nMpH: 8.0Assay Description:Reactions were performed in a total volume of 200 mL, which contained thefollowing components: 20mM Tris-buffer, pH 8.0, 10mM DTT, 30 mM Z-RLRGG-AMC,...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetReplicase polyprotein 1a/Z-RLRGG-AMC(Human SARS coronavirus (SARS-CoV))
Gyeongsang National University

LigandPNGBDBM50441633(4-Hydroxyisocordoin | ISOBAVACHALCONE | Isobacacha...)
Affinity DataKi:  9.10E+3nMpH: 8.0Assay Description:Reactions were performed in a total volume of 200 mL, which contained thefollowing components: 20mM Tris-buffer, pH 8.0, 10mM DTT, 30 mM Z-RLRGG-AMC,...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetTyrosine-protein phosphatase non-receptor type 1(Homo sapiens (Human))
Toho University

Curated by ChEMBL
LigandPNGBDBM50441633(4-Hydroxyisocordoin | ISOBAVACHALCONE | Isobacacha...)
Affinity DataIC50:  2.73E+4nMAssay Description:Inhibition of PTP1B (unknown origin) using p-nitrophenyl phosphate as substrateMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDihydroorotate dehydrogenase (quinone), mitochondrial(Homo sapiens (Human))
West China Hospital

Curated by ChEMBL
LigandPNGBDBM50441633(4-Hydroxyisocordoin | ISOBAVACHALCONE | Isobacacha...)
Affinity DataIC50:  130nMAssay Description:Inhibition of human DHODHMore data for this Ligand-Target Pair
In DepthDetails PubMed