Showing entry for D-Alanine


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0014659
Compound NameD-Alanine
Structure
FormulaC3H7NO2
InchiKeyQNAYBMKLOCPYGJ-UWTATZPHSA-N
SMILESC[C@H](C(=O)O)N
InchiInChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m1/s1
IUPAC(2R)-2-azaniumylpropanoate
Molecular Weight89.05
Pubchem Id71080
Chembl IdCHEMBL66693
Targets of Information Source
DrugBank DB01786
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
P43133 BXGT010359 Thermolysin reviewed - nprS experimental -
P15555 BXGT008138 D-alanyl-D-alanine carboxypeptidase reviewed - - experimental -
PDB DAL
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
P56650 BXGT011187 Lantibiotic actagardine reviewed - - - - -
P80324 BXGT011893 D-amino-acid oxidase reviewed DAO1 - - - - -
P15555 BXGT008138 D-alanyl-D-alanine carboxypeptidase reviewed - - - - -
P00800 BXGT005661 Thermolysin reviewed npr - - - - -
P0AGC3 BXGT007370 Soluble lytic murein transglycosylase reviewed slt - - - - -
P86047 BXGT012084 Lantibiotic epilancin 15X reviewed elxA - - - - -
P29559 BXGT009363 Lantibiotic nisin-Z reviewed nisZ - - - - -
P0A334 BXGT007007 pH-gated potassium channel KcsA reviewed kcsA - - - - -
P39844 BXGT010146 D-alanyl-D-alanine carboxypeptidase DacC reviewed dacC - - - - -
P01308 BXGT005749 Insulin reviewed INS - - - - -
C1J5M6 BXGT002424 Mu-conotoxin BuIIIB reviewed - - - - -
P26349 BXGT009103 Exendin-4 reviewed - - - - -
Q76VI8 BXGT016879 Fibritin unreviewed wac - - - - -
Q5SHZ3 BXGT015698 D-alanine--D-alanine ligase reviewed ddl - - - - -
Q81G39 BXGT017323 D-alanine--D-alanyl carrier protein ligase reviewed dltA - - - - -
P03369 BXGT006058 Gag-Pol polyprotein reviewed gag-pol - - - - -
Q11T61 BXGT013221 D-Ala-D/L-Ala epimerase reviewed tfdD - - - - -
P0CG48 BXGT007468 Polyubiquitin-C reviewed UBC Nucleic acid binding - - - -
P0AEX9 BXGT007333 Maltose/maltodextrin-binding periplasmic protein reviewed malE - - - - -
P00720 BXGT005625 Endolysin reviewed E - - - - -
Q161M1 BXGT013622 Racemase, putative unreviewed RD1_3860 - - - - -
P02640 BXGT005907 Villin-1 reviewed VIL1 - - - - -
Q9BXH1 BXGT020167 Bcl-2-binding component 3 reviewed BBC3 - - - - -
P07862 BXGT006691 D-alanine--D-alanine ligase B reviewed ddlB - - - - -
Q8ZPA3 BXGT019228 Putative periplasmic binding protein unreviewed STM1633 - - - - -
Q6RYW5 BXGT016514 Outer membrane protein Omp38 reviewed omp38 - - - - -
Q9JN36 BXGT020843 D,D-dipeptidase/D,D-carboxypeptidase unreviewed vanXYc - - - - -
Q1QZT7 BXGT013842 TRAP dicarboxylate transporter, DctP subunit unreviewed Csal_0660 - - - - -
Q311Q1 BXGT014309 TRAP dicarboxylate transporter, DctP subunit unreviewed Dde_1548 - - - - -
Q8DQQ1 BXGT018019 Uncharacterized protein unreviewed spr0554 - - - - -
D9IEF7 BXGT003025 Endolysin unreviewed e - - - - -
O25255 BXGT004245 Conserved hypothetical secreted protein unreviewed HP_0518 - - - 224000 -
Q8ZIE7 BXGT019182 D-alanine--D-alanine ligase reviewed ddl - - - - -
Q948Z4 BXGT019557 Snakin-1 reviewed SN1 - - - - -
P62987 BXGT011478 Ubiquitin-60S ribosomal protein L40 reviewed UBA52 Nucleic acid binding - - - -
P22629 BXGT008788 Streptavidin reviewed - - - - -
A3NZL3 BXGT001177 D-alanine--D-alanine ligase reviewed ddl - - - - -
P0CG47 BXGT007467 Polyubiquitin-B reviewed UBB Nucleic acid binding - - - -
Q9KWM4 BXGT021019 Lantibiotic nukacin reviewed nukA - - - - -
Q47746 BXGT014718 D-alanyl-D-alanine carboxypeptidase reviewed vanYB - - - - -
A0A3F2YLX0 BXGT023801 Gln-dal-cys-ala-phe-gly-pro-phe-dbb-phe-val-cys-bh2-gly unreviewed durA - - - - -
A0A3F2YLX2 BXGT023802 Cys-lys-gln-dal-cys-ala-phe-gly-pro-phe-dbb-phe-val-cys-bh2-gly-asn-dbb-lys unreviewed - - - - -
Q6LX42 BXGT023835 Sodium/alanine symporter AgcS reviewed agcS - - - - -
P10636 BXGT007596 Microtubule-associated protein tau reviewed MAPT - - - - -
Q10Z45 BXGT013214 Extracellular solute-binding protein, family 1 unreviewed Tery_3377 - - - - -
A0A3S8RJF8 BXGT024775 D-alanine--D-alanine ligase unreviewed ddl - - - - -
Q9RQB6 BXGT024942 Flagellar hook protein FlgE unreviewed flgE - - - - -
P01501 BXGT025041 Melittin reviewed MELT - - - - -
Q5NH85 BXGT025712 Outer membrane associated protein unreviewed fopA1 - - - - -
Binding DB 50000109
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 BXGT009831 Glutamate receptor ionotropic, NMDA 1 reviewed Grin1 - 90900 - -
reviewed BXGT017247 Proton-coupled amino acid transporter 1 reviewed Transporter SLC36A1 19000000 - - -
CHEMBL CHEMBL66693
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
Q9R1M7 BXGT021417 Glutamate receptor ionotropic, NMDA 3A reviewed - Grin3a Ki '=' 630 nM
Q8VHN2 BXGT018931 Glutamate receptor ionotropic, NMDA 3B reviewed - Grin3b Ki '=' 630 nM
Q62645 BXGT016035 Glutamate receptor ionotropic, NMDA 2D reviewed - Grin2d Ki '=' 630 nM
Q00961 BXGT012556 Glutamate receptor ionotropic, NMDA 2C reviewed - Grin2c Ki '=' 630 nM
Q00960 BXGT012555 Glutamate receptor ionotropic, NMDA 2B reviewed - Grin2b Ki '=' 630 nM
Q00959 BXGT012554 Glutamate receptor ionotropic, NMDA 2A reviewed - Grin2a Ki '=' 630 nM
P35439 BXGT009831 Glutamate receptor ionotropic, NMDA 1 reviewed - Grin1 Ki '=' 630 nM
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 AC50 - - -
Q91Y77 BXGT019323 Monocarboxylate transporter 10 reviewed - Slc16a10 Activity - - -
P05177 BXGT006336 Cytochrome P450 1A2 reviewed Enzyme CYP1A2 AC50 '=' 31622 nM
P10635 BXGT007595 Cytochrome P450 2D6 reviewed - CYP2D6 AC50 - - -
P35439 BXGT009831 Glutamate receptor ionotropic, NMDA 1 reviewed - Grin1 IC50 '=' 90900 nM
Q7Z2H8 BXGT017247 Proton-coupled amino acid transporter 1 reviewed Transporter SLC36A1 pKi '=' -1 mM
P33261 BXGT009707 Cytochrome P450 2C19 reviewed - CYP2C19 AC50 - - -
P11712 BXGT007738 Cytochrome P450 2C9 reviewed - CYP2C9 AC50 - - -
Q9F4F7 BXGT020344 4'-phosphopantetheinyl transferase ffp reviewed - ffp Potency '=' 17782 nM
Q7Z2H8 BXGT017247 Proton-coupled amino acid transporter 1 reviewed Transporter SLC36A1 Ki '=' 19000000 nM
P49798 BXGT010745 Regulator of G-protein signaling 4 reviewed Enzyme modulator RGS4 Potency - 21192 nM
Q9Z1J7 BXGT022405 Amino acid transporter unreviewed - Slc1a5 Inhibition '>=' 25 %
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00008 Garlic Allium sativum Herbs and Spices
BXGF00027 Chinese mustard Brassica juncea Vegetables
BXGF00181 Dandelion Taraxacum officinale Herbs and Spices
BXGF00337 Ginkgo nuts Ginkgo biloba Herbs and Spices
BXGF00380 White mustard Sinapis alba Herbs and Spices
BXGF01140 Angelica gigas Angelica gigas Medicinal Plant
BXGF01185 Aloe vera Aloe vera Medicinal Plant
BXGF01668 Taraxacum platycarpum Taraxacum platycarpum Medicinal Plant
BXGF01900 Aloe ferox Aloe ferox Medicinal Plant
BXGF01911 Bupleurum scorzonerifolium Bupleurum scorzonerifolium Medicinal Plant
BXGF02049 Angelica sinensis Angelica sinensis Medicinal Plant
BXGF02152 Taraxacum borealisinense Taraxacum borealisinense Others
BXGF02275 Trichosanthes kirilowii maxim Trichosanthes kirilowii maxim Others
BXGF02526 Santalum album Santalum album Medicinal Plant
BXGF03630 Taraxacum coreanum Taraxacum coreanum Others
BXGF04310 Taraxacum mongolicum Taraxacum mongolicum Medicinal Plant
BXGF04631 Aloe spicata Aloe spicata Medicinal Plant
BXGF04842 Angelica acutiloba Angelica acutiloba Medicinal Plant
BXGF04875 Bupleurum chinense Bupleurum chinense Medicinal Plant
BXGF04926 Aloe africana Aloe africana Medicinal Plant
BXGF04981 Bupleurum falcatum Bupleurum falcatum Medicinal Plant
BXGF05330 Arum ternatum thunb Arum ternatum thunb Others
BXGF05421 Tussilago farfara Tussilago farfara 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