Showing entry for Dalfampridine


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0047867
Compound NameDalfampridine
Structure
FormulaC5H6N2
InchiKeyNUKYPUAOHBNCPY-UHFFFAOYSA-N
SMILESN=c1cc[nH]cc1
InchiInChI=1S/C5H6N2/c6-5-1-3-7-4-2-5/h1-4H,(H2,6,7)
IUPACpyridin-4-amine
Molecular Weight94.05
Pubchem Id1727
Chembl IdCHEMBL284348
Targets of Information Source
DrugBank DB06637
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
Q09470 BXGT013037 Potassium voltage-gated channel subfamily A member 1 reviewed Ion channel KCNA1 approved antagonist
P16389 BXGT008221 Potassium voltage-gated channel subfamily A member 2 reviewed Ion channel KCNA2 approved antagonist
P22001 BXGT008716 Potassium voltage-gated channel subfamily A member 3 reviewed Ion channel KCNA3 approved antagonist
P22459 BXGT008773 Potassium voltage-gated channel subfamily A member 4 reviewed Ion channel KCNA4 approved antagonist
P22460 BXGT008774 Potassium voltage-gated channel subfamily A member 5 reviewed Ion channel KCNA5 approved antagonist
P17658 BXGT008326 Potassium voltage-gated channel subfamily A member 6 reviewed Ion channel KCNA6 approved antagonist
Q96RP8 BXGT019731 Potassium voltage-gated channel subfamily A member 7 reviewed Ion channel KCNA7 approved antagonist
Q16322 BXGT013626 Potassium voltage-gated channel subfamily A member 10 reviewed Ion channel KCNA10 approved antagonist
Q14721 BXGT013502 Potassium voltage-gated channel subfamily B member 1 reviewed Ion channel KCNB1 approved antagonist
Q92953 BXGT019398 Potassium voltage-gated channel subfamily B member 2 reviewed Ion channel KCNB2 approved antagonist
P48547 BXGT010643 Potassium voltage-gated channel subfamily C member 1 reviewed Ion channel KCNC1 approved antagonist
Q96PR1 BXGT019710 Potassium voltage-gated channel subfamily C member 2 reviewed Ion channel KCNC2 approved antagonist
Q14003 BXGT013434 Potassium voltage-gated channel subfamily C member 3 reviewed Ion channel KCNC3 approved antagonist
Q9NSA2 BXGT021203 Potassium voltage-gated channel subfamily D member 1 reviewed Ion channel KCND1 approved antagonist
Q9NZV8 BXGT021283 Potassium voltage-gated channel subfamily D member 2 reviewed Ion channel KCND2 approved antagonist
Q9UK17 BXGT021735 Potassium voltage-gated channel subfamily D member 3 reviewed Ion channel KCND3 approved antagonist
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 10458
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 BXGT009967 Acetylcholinesterase reviewed Ache - >500000 - -
reviewed BXGT005348 Potassium channel subfamily K member 2 reviewed Ion channel KCNK2 - - - 2750000
reviewed BXGT005644 Cationic trypsin reviewed - >2000000 - - -
reviewed BXGT008716 Potassium voltage-gated channel subfamily A member 3 reviewed Ion channel KCNA3 - - 195000 -
reviewed BXGT005639 Plasminogen reviewed Enzyme PLG >2000000 - - -
reviewed BXGT005630 Prothrombin reviewed Enzyme F2 >2000000 - - -
reviewed BXGT013267 Potassium voltage-gated channel subfamily H member 2 reviewed Ion channel KCNH2 - 4400000 - -
reviewed BXGT012615 Pteridine reductase 1 reviewed PTR1 - 1900000 - -
reviewed BXGT017908 High affinity choline transporter 1 reviewed Slc5a7 480839.35 - - -
reviewed BXGT013267 Potassium voltage-gated channel subfamily H member 2 reviewed Ion channel KCNH2 - 4365158.32 - -
CHEMBL CHEMBL284348
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
P00374 BXGT005520 Dihydrofolate reductase reviewed Enzyme DHFR Inhibition - - -
P10636 BXGT007596 Microtubule-associated protein tau reviewed - MAPT Potency '=' 8912 nM
P22001 BXGT008716 Potassium voltage-gated channel subfamily A member 3 reviewed Ion channel KCNA3 Kd '=' 195000 nM
Q03164 BXGT012700 Histone-lysine N-methyltransferase 2A reviewed - KMT2A Potency '=' 39810 nM
O00255 BXGT003903 Menin reviewed - MEN1 Potency '=' 39810 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 89125 nM
P25779 BXGT009067 Cruzipain reviewed - Potency '=' 3548 nM
Q01782 BXGT012615 Pteridine reductase 1 reviewed - PTR1 IC50 '=' 1900000 nM
P02545 BXGT005889 Prelamin-A/C reviewed - LMNA Potency '=' 891 nM
P11712 BXGT007738 Cytochrome P450 2C9 reviewed - CYP2C9 AC50 - - -
Q12809 BXGT013267 Potassium voltage-gated channel subfamily H member 2 reviewed Ion channel KCNH2 IC50 '=' 4400000 nM
P00760 BXGT005644 Cationic trypsin reviewed - Ki '>' 2000000 nM
P83916 BXGT012025 Chromobox protein homolog 1 reviewed Epigenetic regulator CBX1 Potency - 37685 nM
O15648 BXGT004185 ATP-dependent 6-phosphofructokinase reviewed - pfk Potency - 756 nM
Q9NY46 BXGT021248 Sodium channel protein type 3 subunit alpha reviewed Ion channel SCN3A Inhibition '=' 1 %
Q99250 BXGT019913 Sodium channel protein type 2 subunit alpha reviewed Ion channel SCN2A Inhibition '=' 1 %
P35498 BXGT009838 Sodium channel protein type 1 subunit alpha reviewed Ion channel SCN1A Inhibition '=' 1 %
P25779 BXGT009067 Cruzipain reviewed - Potency '=' 3162 nM
P28482 BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 Potency '=' 10000 nM
P10635 BXGT007595 Cytochrome P450 2D6 reviewed - CYP2D6 AC50 '=' 63 nM
Q9NY46 BXGT021248 Sodium channel protein type 3 subunit alpha reviewed Ion channel SCN3A Inhibition '=' 3 %
Q99250 BXGT019913 Sodium channel protein type 2 subunit alpha reviewed Ion channel SCN2A Inhibition '=' 3 %
P35498 BXGT009838 Sodium channel protein type 1 subunit alpha reviewed Ion channel SCN1A Inhibition '=' 3 %
P00747 BXGT005639 Plasminogen reviewed Enzyme PLG Ki '>' 2000000 nM
P05177 BXGT006336 Cytochrome P450 1A2 reviewed Enzyme CYP1A2 AC50 - - -
P00734 BXGT005630 Prothrombin reviewed Enzyme F2 Ki '>' 2000000 nM
P04062 BXGT006140 Lysosomal acid glucosylceramidase reviewed - GBA Potency - 631 nM
Q12809 BXGT013267 Potassium voltage-gated channel subfamily H member 2 reviewed Ion channel KCNH2 IC50 '=' 4365158 nM
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 AC50 - - -
P83916 BXGT012025 Chromobox protein homolog 1 reviewed Epigenetic regulator CBX1 Potency - 100000 nM
P37136 BXGT009967 Acetylcholinesterase reviewed - Ache Relative potency '<' 0 -
P10635 BXGT007595 Cytochrome P450 2D6 reviewed - CYP2D6 Potency '=' 63 nM
O95398 BXGT005378 Rap guanine nucleotide exchange factor 3 reviewed Enzyme modulator RAPGEF3 Potency - 28183 nM
O75496 BXGT005132 Geminin reviewed - GMNN Potency - 6309 nM
P07382 BXGT006618 Bifunctional dihydrofolate reductase-thymidylate synthase reviewed - LmjF06.0860 Inhibition - - -
Q8BGY9 BXGT017908 High affinity choline transporter 1 reviewed - Slc5a7 Ki '=' 480839 nM
Q09470 BXGT013037 Potassium voltage-gated channel subfamily A member 1 reviewed Ion channel KCNA1 IC50 '=' 89000 nM
P25094 BXGT009014 Peripheral myelin protein 22 reviewed - Pmp22 Potency - 25099 nM
Q16637 BXGT013646 Survival motor neuron protein reviewed Epigenetic regulator SMN1 Potency '=' 1000 nM
P37136 BXGT009967 Acetylcholinesterase reviewed - Ache IC50 '>' 500000 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 22 nM
P00352 BXGT005510 Retinal dehydrogenase 1 reviewed Enzyme ALDH1A1 Potency '=' 44668 nM
P16473 BXGT008234 Thyrotropin receptor reviewed G-protein coupled receptor TSHR Potency '=' 125 nM
P11308 BXGT007684 Transcriptional regulator ERG reviewed Transcription factor ERG Potency - 2818 nM
P15917 BXGT008169 Lethal factor reviewed - lef Potency '=' 7943 nM
P27695 BXGT009199 DNA-(apurinic or apyrimidinic site) lyase reviewed - APEX1 Potency - 1995262 nM
O75874 BXGT005157 Isocitrate dehydrogenase [NADP] cytoplasmic reviewed - IDH1 Potency - 29092 nM
P04150 BXGT006154 Glucocorticoid receptor reviewed Nuclear receptor NR3C1 Potency - 7079 nM
O94782 BXGT005332 Ubiquitin carboxyl-terminal hydrolase 1 reviewed Enzyme USP1 Potency - 14125 nM
P33261 BXGT009707 Cytochrome P450 2C19 reviewed - CYP2C19 AC50 - - -
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF01823 Houttuynia cordata Houttuynia cordata Medicinal Plant
BXGF02526 Santalum album Santalum album 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