Showing entry for Thiophen-2-carboxyaldehyde


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0002960
Compound NameThiophen-2-carboxyaldehyde
Structure
FormulaC5H4OS
InchiKeyCNUDBTRUORMMPA-UHFFFAOYSA-N
SMILESO=CC1=CC=CS1
InchiInChI=1S/C5H4OS/c6-4-5-2-1-3-7-5/h1-4H
IUPACthiophene-2-carbaldehyde
Molecular Weight112.15
Pubchem Id7364
Chembl IdCHEMBL328441
Targets of Information Source
DrugBank n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
PDB LW1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
P78055 BXGT011827 Fructose-6-phosphate aldolase 1 reviewed fsaA - - - - -
Binding DB 50071926
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT010750 Glycogen synthase kinase-3 beta reviewed Kinase GSK3B - >100000 - -
CHEMBL CHEMBL328441
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
P49841 BXGT010750 Glycogen synthase kinase-3 beta reviewed Kinase GSK3B IC50 '>' 100000 nM
P05164 BXGT006333 Myeloperoxidase reviewed Enzyme MPO Inhibition - - -
P0C6U8 BXGT007435 Replicase polyprotein 1a reviewed - 1a Inhibition '<' 10 %
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00033 Kohlrabi Brassica oleracea var. gongylodes Vegetables
BXGF00039 Capers Capparis spinosa Herbs and Spices
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease