Showing entry for Oroidin


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0027076
Compound NameOroidin
Structure
FormulaC11H11Br2N5O
InchiKeyQKJAXHBFQSBDAR-OWOJBTEDSA-N
SMILESN=c1[nH]cc([nH]1)/C=C/CNC(=O)c1[nH]c(c(c1)Br)Br
InchiInChI=1S/C11H11Br2N5O/c12-7-4-8(18-9(7)13)10(19)15-3-1-2-6-5-16-11(14)17-6/h1-2,4-5,18H,3H2,(H,15,19)(H3,14,16,17)/b2-1+
IUPACN-[(E)-3-(2-amino-1H-imidazol-5-yl)prop-2-enyl]-4,5-dibromo-1H-pyrrole-2-carboxamide
Molecular Weight386.93
Pubchem Id6312649
Chembl IdCHEMBL397591
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 CHEMBL397591
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
Q02750 BXGT012662 Dual specificity mitogen-activated protein kinase kinase 1 reviewed Kinase MAP2K1 IC50 '>' 2500 nM
P04049 BXGT006133 RAF proto-oncogene serine/threonine-protein kinase reviewed Kinase RAF1 IC50 '>' 2500 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 800 nM
P28482 BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 IC50 '>' 2500 nM
Q02750 BXGT012662 Dual specificity mitogen-activated protein kinase kinase 1 reviewed Kinase MAP2K1 IC50 '=' 2500 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI Ki '=' 400 nM
Q965D5 BXGT019600 Enoyl-acyl-carrier protein reductase unreviewed - fabI IC50 '=' 0 ug.mL-1
P10499 BXGT026105 Potassium voltage-gated channel subfamily A member 1 reviewed - Kcna1 Inhibition - - -
P22459 BXGT008773 Potassium voltage-gated channel subfamily A member 4 reviewed Ion channel KCNA4 IC50 '=' 2100 nM
P22460 BXGT008774 Potassium voltage-gated channel subfamily A member 5 reviewed Ion channel KCNA5 IC50 '=' 16000 nM
P63142 BXGT011503 Potassium voltage-gated channel subfamily A member 2 reviewed - Kcna2 Inhibition '=' 10 %
P17659 BXGT026134 Potassium voltage-gated channel subfamily A member 6 reviewed - Kcna6 IC50 '>' 10000 nM
P15384 BXGT026154 Potassium voltage-gated channel subfamily A member 3 reviewed - Kcna3 Inhibition '=' 58 %
P17659 BXGT026134 Potassium voltage-gated channel subfamily A member 6 reviewed - Kcna6 Inhibition - - -
P22001 BXGT008716 Potassium voltage-gated channel subfamily A member 3 reviewed Ion channel KCNA3 IC50 '=' 4700 nM
P17658 BXGT008326 Potassium voltage-gated channel subfamily A member 6 reviewed Ion channel KCNA6 IC50 '=' 4900 nM
P15385 BXGT026156 Potassium voltage-gated channel subfamily A member 4 reviewed - Kcna4 Inhibition '=' 32 %
P15385 BXGT026156 Potassium voltage-gated channel subfamily A member 4 reviewed - Kcna4 IC50 '=' 5700 nM
Q09470 BXGT013037 Potassium voltage-gated channel subfamily A member 1 reviewed Ion channel KCNA1 IC50 '>' 30000 nM
P16389 BXGT008221 Potassium voltage-gated channel subfamily A member 2 reviewed Ion channel KCNA2 IC50 '=' 20000 nM
P15384 BXGT026154 Potassium voltage-gated channel subfamily A member 3 reviewed - Kcna3 IC50 '=' 820 nM
Q63472 BXGT026163 Potassium voltage-gated channel subfamily H member 1 reviewed - Kcnh1 Inhibition - - -
P19024 BXGT026169 Potassium voltage-gated channel subfamily A member 5 reviewed - Kcna5 Inhibition - - -
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF04370 Monochaetum vulcanicum Monochaetum vulcanicum Others
BXGF04477 Artemisia vestita Artemisia vestita Medicinal Plant
BXGF05755 Vernonia arctioides Vernonia arctioides Others
BXGF06051 Echinocystis fabacea Echinocystis fabacea 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