Showing entry for Benzenemethanethiol


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0044387
Compound NameBenzenemethanethiol
Structure
FormulaC7H8S
InchiKeyUENWRTRMUIOCKN-UHFFFAOYSA-N
SMILESSCc1ccccc1
InchiInChI=1S/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
IUPACphenylmethanethiol
Molecular Weight124.03
Pubchem Id7509
Chembl IdCHEMBL1224557
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 50325566
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 BXGT008065 Indoleamine 2,3-dioxygenase 1 reviewed IDO1 - 1700 - -
reviewed BXGT008065 Indoleamine 2,3-dioxygenase 1 reviewed IDO1 - 13000 - -
CHEMBL CHEMBL1224557
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
P14902 BXGT008065 Indoleamine 2,3-dioxygenase 1 reviewed - IDO1 IC50 '=' 13000 nM
P14902 BXGT008065 Indoleamine 2,3-dioxygenase 1 reviewed - IDO1 IC50 '=' 1700 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF01428 Euphorbia royleana Euphorbia royleana Medicinal Plant
BXGF04303 Anemarrhena asphodeloides Anemarrhena asphodeloides 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