Showing entry for Sulforaphane


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0006216
Compound NameSulforaphane
Structure
FormulaC6H11NOS2
InchiKeySUVMJBTUFCVSAD-UHFFFAOYSA-N
SMILESCS(=O)CCCCN=C=S
InchiInChI=1S/C6H11NOS2/c1-10(8)5-3-2-4-7-6-9/h2-5H2,1H3
IUPAC1-isothiocyanato-4-methanesulfinylbutane
Molecular Weight177.29
Pubchem Id5350
Chembl IdCHEMBL48802
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 50073654
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 BXGT007991 Macrophage migration inhibitory factor reviewed MIF - 2200 - -
reviewed BXGT007991 Macrophage migration inhibitory factor reviewed MIF - 11000 - -
reviewed BXGT009355 Nitric oxide synthase, inducible reviewed Nos2 - 400 - -
reviewed BXGT005575 Epidermal growth factor receptor reviewed Kinase EGFR - 9000 - -
reviewed BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 - - - 1200
CHEMBL CHEMBL48802
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
Q14145 BXGT013448 Kelch-like ECH-associated protein 1 reviewed - KEAP1 Inhibition - - -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Inhibition - - -
P04637 BXGT006243 Cellular tumor antigen p53 reviewed Transcription factor TP53 Activity - - -
P15559 BXGT008139 NAD(P)H dehydrogenase [quinone] 1 reviewed - NQO1 Activity - - -
Q60795 BXGT016000 Nuclear factor erythroid 2-related factor 2 reviewed - Nfe2l2 FC '=' 3 -
Q60795 BXGT016000 Nuclear factor erythroid 2-related factor 2 reviewed - Nfe2l2 Activity - - -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 2 -
Q06124 BXGT012856 Tyrosine-protein phosphatase non-receptor type 11 reviewed - PTPN11 Inhibition - - -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 EC50 '=' 1200 nM
P15559 BXGT008139 NAD(P)H dehydrogenase [quinone] 1 reviewed - NQO1 CD '=' 0 uM
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 K '=' 1 10'-4/s
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz CD '=' 0 uM
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 12 -
P30561 BXGT009444 Aryl hydrocarbon receptor reviewed - Ahr Activity '=' 0 -
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz Activity '=' 0 uM
P27338 BXGT009172 Amine oxidase [flavin-containing] B reviewed - MAOB FC '=' 1 -
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz CD '=' 0 ug ml-1
P15559 BXGT008139 NAD(P)H dehydrogenase [quinone] 1 reviewed - NQO1 Activity '=' 50 %
P18031 BXGT008369 Tyrosine-protein phosphatase non-receptor type 1 reviewed - PTPN1 K '=' 2 /M/s
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 Activity - - -
Q14145 BXGT013448 Kelch-like ECH-associated protein 1 reviewed - KEAP1 FC '=' 5 -
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz CD '=' 0 uM
Q64669 BXGT016128 NAD(P)H dehydrogenase [quinone] 1 reviewed - Nqo1 CD '=' 0 uM
Q92887 BXGT019389 Canalicular multispecific organic anion transporter 1 reviewed Transporter ABCC2 Activity - - -
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz Activity '=' 0 uM
P00184 BXGT005483 Cytochrome P450 1A1 reviewed - Cyp1a1 Ratio '=' 0 -
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz CD '=' 0 uM
Q64669 BXGT016128 NAD(P)H dehydrogenase [quinone] 1 reviewed - Nqo1 CD '=' 0 uM
P25084 BXGT009013 Transcriptional activator protein LasR reviewed - lasR Inhibition - - -
Q60795 BXGT016000 Nuclear factor erythroid 2-related factor 2 reviewed - Nfe2l2 Activity '=' 40 %
P15559 BXGT008139 NAD(P)H dehydrogenase [quinone] 1 reviewed - NQO1 FC '=' 3 -
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz CD '=' 0 uM
Q60795 BXGT016000 Nuclear factor erythroid 2-related factor 2 reviewed - Nfe2l2 Activity '=' 20 %
Q64669 BXGT016128 NAD(P)H dehydrogenase [quinone] 1 reviewed - Nqo1 Ratio '=' 3 -
P14174 BXGT007991 Macrophage migration inhibitory factor reviewed - MIF IC50 '=' 11000 nM
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz CQ '=' 10 uM
Q14145 BXGT013448 Kelch-like ECH-associated protein 1 reviewed - KEAP1 FC '=' 2 -
Q14145 BXGT013448 Kelch-like ECH-associated protein 1 reviewed - KEAP1 FC '=' 8 -
P14174 BXGT007991 Macrophage migration inhibitory factor reviewed - MIF IC50 '=' 2200 nM
Q60795 BXGT016000 Nuclear factor erythroid 2-related factor 2 reviewed - Nfe2l2 FC '=' 3 -
Q60795 BXGT016000 Nuclear factor erythroid 2-related factor 2 reviewed - Nfe2l2 Activity '=' 229 %
P00533 BXGT005575 Epidermal growth factor receptor reviewed Kinase EGFR IC50 '=' 9000 nM
P25084 BXGT009013 Transcriptional activator protein LasR reviewed - lasR Activity - - -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 18 -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 8 -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 3 -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 EC50 '=' 19080 nM
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz Activity '=' 0 uM
P00533 BXGT005575 Epidermal growth factor receptor reviewed Kinase EGFR Inhibition '=' 69 %
Q60795 BXGT016000 Nuclear factor erythroid 2-related factor 2 reviewed - Nfe2l2 CD '=' 0 uM
Q63120 BXGT016061 Canalicular multispecific organic anion transporter 1 reviewed - Abcc2 Activity - - -
Q9Z2X8 BXGT022415 Kelch-like ECH-associated protein 1 reviewed - Keap1 CD '=' 200 nM
Q60795 BXGT016000 Nuclear factor erythroid 2-related factor 2 reviewed - Nfe2l2 CD '=' 200 nM
Q06124 BXGT012856 Tyrosine-protein phosphatase non-receptor type 11 reviewed - PTPN11 Kapp '=' 3 /M/s
P29477 BXGT009355 Nitric oxide synthase, inducible reviewed - Nos2 IC50 '=' 400 nM
P54292 BXGT011041 Regulatory protein RhlR reviewed - rhlR Inhibition - - -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 11 -
P21397 BXGT008644 Amine oxidase [flavin-containing] A reviewed - MAOA FC '=' 0 -
Q16236 BXGT013624 Nuclear factor erythroid 2-related factor 2 reviewed Enzyme NFE2L2 FC '=' 5 -
Q14145 BXGT013448 Kelch-like ECH-associated protein 1 reviewed - KEAP1 FC '=' 1 -
Q14145 BXGT013448 Kelch-like ECH-associated protein 1 reviewed - KEAP1 FC '=' 18 -
P47199 BXGT010568 Quinone oxidoreductase reviewed - Cryz FC '=' 2 -
P27338 BXGT009172 Amine oxidase [flavin-containing] B reviewed - MAOB FC '=' 0 -
P21397 BXGT008644 Amine oxidase [flavin-containing] A reviewed - MAOA FC '=' 0 -
Q06124 BXGT012856 Tyrosine-protein phosphatase non-receptor type 11 reviewed - PTPN11 Kapp '=' 3 /M/s
Q64669 BXGT016128 NAD(P)H dehydrogenase [quinone] 1 reviewed - Nqo1 CD '=' 0 uM
Q60795 BXGT016000 Nuclear factor erythroid 2-related factor 2 reviewed - Nfe2l2 FC '=' 1 -
P54292 BXGT011041 Regulatory protein RhlR reviewed - rhlR Inhibition '=' 42 %
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00002 Savoy cabbage Brassica oleracea var. sabauda Vegetables
BXGF00032 Brussel sprouts Brassica oleracea var. gemmifera Vegetables
BXGF00034 Broccoli Brassica oleracea var. italica Vegetables
BXGF00153 Radish Raphanus sativus Vegetables
BXGF00803 Cabbage Brassica oleracea var. capitata Vegetables
BXGF00809 Brassicas Vegetables
BXGF00839 White cabbage Brassica oleracea L. var. capitata L. f. alba DC. Vegetables
BXGF02330 Codonopsis pilosula Codonopsis pilosula Medicinal Plant
BXGF05480 Lepidium draba Lepidium draba 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