Showing entry for 2-Methyl-1,1-Dioxo-1,2-Benzothiazol-3-One


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0023605
Compound Name2-Methyl-1,1-Dioxo-1,2-Benzothiazol-3-One
Structure
FormulaC8H7NO3S
InchiKeyDDIIAJRLFATEEE-UHFFFAOYSA-N
SMILESO=C1c2ccccc2S(=O)(=O)N1C
InchiInChI=1S/C8H7NO3S/c1-9-8(10)6-4-2-3-5-7(6)13(9,11)12/h2-5H,1H3
IUPAC2-methyl-1,1-dioxo-1,2-benzothiazol-3-one
Molecular Weight197.01
Pubchem Id27290
Chembl IdCHEMBL131790
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 n.a
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
Binding DB n.a
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
CHEMBL CHEMBL131790
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
P00918 BXGT005690 Carbonic anhydrase 2 reviewed - CA2 Ki '=' 2600 nM
O43570 BXGT004601 Carbonic anhydrase 12 reviewed - CA12 Ki '>' 50000 nM
Q16790 BXGT013670 Carbonic anhydrase 9 reviewed - CA9 Ki '=' 400 nM
P00915 BXGT005689 Carbonic anhydrase 1 reviewed - CA1 Ki '>' 50000 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00906 Psammosilene tunicoides Psammosilene tunicoides Others
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