BDBM50240948 CHEMBL359965::S-allyl prop-2-ene-1-sulfinothioate::allicin::thio-2-propene-1-sulfinic acid S-allyl ester

SMILES C=CCSS(=O)CC=C

InChI Key InChIKey=JDLKFOPOAOFWQN-UHFFFAOYSA-N

Data  3 KI  1 IC50  3 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 7 hits for monomerid = 50240948   

TargetCysteine protease(Trypanosoma brucei rhodesiense)
University Of WüRzburg

Curated by ChEMBL
LigandPNGBDBM50240948(CHEMBL359965 | S-allyl prop-2-ene-1-sulfinothioate...)
Affinity DataKi:  5.31E+3nMAssay Description:Inhibition of Trypanosoma brucei rhodesiense rhodesainMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCathepsin B(Homo sapiens (Human))
University Of WüRzburg

Curated by ChEMBL
LigandPNGBDBM50240948(CHEMBL359965 | S-allyl prop-2-ene-1-sulfinothioate...)
Affinity DataKi:  8.60E+3nMAssay Description:Inhibition of cathepsin BMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProcathepsin L(Homo sapiens (Human))
University Of WüRzburg

Curated by ChEMBL
LigandPNGBDBM50240948(CHEMBL359965 | S-allyl prop-2-ene-1-sulfinothioate...)
Affinity DataKi:  9.30E+3nMAssay Description:Inhibition of cathepsin LMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetTransient receptor potential cation channel subfamily V member 1(Rattus norvegicus (rat))
Ferrara University

Curated by ChEMBL
LigandPNGBDBM50240948(CHEMBL359965 | S-allyl prop-2-ene-1-sulfinothioate...)
Affinity DataEC50:  5.12E+4nMAssay Description:Activation of rat TRPV1 channelMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetTransient receptor potential cation channel subfamily A member 1(Homo sapiens (Human))
Ferrara University

Curated by ChEMBL
LigandPNGBDBM50240948(CHEMBL359965 | S-allyl prop-2-ene-1-sulfinothioate...)
Affinity DataEC50:  1.91E+3nMAssay Description:Activation of human TRPA1 channelMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMitochondrial 2-oxodicarboxylate carrier(Homo sapiens)
Michigan State University

Curated by ChEMBL
LigandPNGBDBM50240948(CHEMBL359965 | S-allyl prop-2-ene-1-sulfinothioate...)
Affinity DataIC50:  11nMAssay Description:Inhibition of ODC (unknown origin) expressed in Escherichia coli after 30 mins in presence of [1-14C] L-ornithine by liquid scintillation counter ana...More data for this Ligand-Target Pair
In DepthDetails PubMed
TargetTransient receptor potential cation channel subfamily A member 1(Mus musculus)
Ferrara University

Curated by ChEMBL
LigandPNGBDBM50240948(CHEMBL359965 | S-allyl prop-2-ene-1-sulfinothioate...)
Affinity DataEC50:  1.32E+3nMAssay Description:Activation of mouse TRPA1 channelMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed