Showing entry for Methyl 2,4-Dihydroxybenzoate


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0053251
Compound NameMethyl 2,4-Dihydroxybenzoate
Structure
FormulaC8H8O4
InchiKeyIIFCLXHRIYTHPV-UHFFFAOYSA-N
SMILESCOC(=O)c1ccc(cc1O)O
InchiInChI=1S/C8H8O4/c1-12-8(11)6-3-2-5(9)4-7(6)10/h2-4,9-10H,1H3
IUPACmethyl 2,4-dihydroxybenzoate
Molecular Weight168.04
Pubchem Id16523
Chembl IdCHEMBL486026
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 50428378
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 BXGT013670 Carbonic anhydrase 9 reviewed CA9 890 - - -
reviewed BXGT010364 Carbonic anhydrase 7 reviewed CA7 850 - - -
reviewed BXGT005690 Carbonic anhydrase 2 reviewed CA2 760 - - -
reviewed BXGT005689 Carbonic anhydrase 1 reviewed CA1 830 - - -
reviewed BXGT021769 Carbonic anhydrase 14 reviewed CA14 860 - - -
reviewed BXGT004601 Carbonic anhydrase 12 reviewed CA12 950 - - -
CHEMBL CHEMBL486026
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
Q9ULX7 BXGT021769 Carbonic anhydrase 14 reviewed - CA14 Ki '=' 860 nM
P00915 BXGT005689 Carbonic anhydrase 1 reviewed - CA1 Ki '=' 830 nM
Q16790 BXGT013670 Carbonic anhydrase 9 reviewed - CA9 Ki '=' 890 nM
O43570 BXGT004601 Carbonic anhydrase 12 reviewed - CA12 Ki '=' 950 nM
P00918 BXGT005690 Carbonic anhydrase 2 reviewed - CA2 Ki '=' 760 nM
P43166 BXGT010364 Carbonic anhydrase 7 reviewed - CA7 Ki '=' 850 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF05127 Robinia pseudoacacia Robinia pseudoacacia Medicinal Plant
BXGF05530 Ophioglossum vulgatum Ophioglossum vulgatum Medicinal Plant
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