Showing entry for NG,NG-Dimethyl-L-arginine


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0000245
Compound NameNG,NG-Dimethyl-L-arginine
Structure
FormulaC8H18N4O2
InchiKeyYDGMGEXADBMOMJ-LURJTMIESA-N
SMILESN[C@@H](CCC\N=C(/N)N(C)C)C(O)=O
InchiInChI=1S/C8H18N4O2/c1-12(2)8(10)11-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H2,10,11)(H,13,14)/t6-/m0/s1
IUPAC(2S)-2-amino-5-[(E)-[amino(dimethylamino)methylidene]amino]pentanoic acid
Molecular Weight202.25
Pubchem Id123831
Chembl IdCHEMBL457530
Targets of Information Source
DrugBank DB01686
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
P35228 BXGT009800 Nitric oxide synthase, inducible reviewed - NOS2 experimental -
P29474 BXGT009352 Nitric oxide synthase, endothelial reviewed - NOS3 experimental -
PDB DA2
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
Q16637 BXGT013646 Survival motor neuron protein reviewed SMN1 Epigenetic regulator - - - -
O75940 BXGT005168 Survival of motor neuron-related-splicing factor 30 reviewed SMNDC1 - - - - -
D9J2T9 BXGT003028 Ribosome inactivating protein unreviewed RIP - - - - -
P29473 BXGT009351 Nitric oxide synthase, endothelial reviewed NOS3 - - - - -
Binding DB 92901
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 BXGT005328 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed Enzyme DDAH1 - - - -
reviewed BXGT009354 Nitric oxide synthase, brain reviewed Nos1 700 - - -
CHEMBL CHEMBL457530
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
P56965 BXGT011207 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed - DDAH1 Kcat/Km '=' 8 /mM/min
P11712 BXGT007738 Cytochrome P450 2C9 reviewed - CYP2C9 AC50 - - -
P33261 BXGT009707 Cytochrome P450 2C19 reviewed - CYP2C19 AC50 - - -
O94760 BXGT005328 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed Enzyme DDAH1 Km '=' 170000 nM
Q96KQ7 BXGT019687 Histone-lysine N-methyltransferase EHMT2 reviewed Epigenetic regulator EHMT2 Potency - 1258 nM
P19838 BXGT008526 Nuclear factor NF-kappa-B p105 subunit reviewed Transcription factor NFKB1 Potency '=' 28183 nM
P16473 BXGT008234 Thyrotropin receptor reviewed G-protein coupled receptor TSHR Potency '=' 3981 nM
P56965 BXGT011207 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed - DDAH1 Km '=' 810000 nM
O08557 BXGT004030 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed - Ddah1 Km '=' 180000 nM
P10635 BXGT007595 Cytochrome P450 2D6 reviewed - CYP2D6 AC50 - - -
P05177 BXGT006336 Cytochrome P450 1A2 reviewed Enzyme CYP1A2 AC50 - - -
P08684 BXGT006812 Cytochrome P450 3A4 reviewed Enzyme CYP3A4 AC50 - - -
O94760 BXGT005328 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed Enzyme DDAH1 Kcat - - -
P56965 BXGT011207 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed - DDAH1 Kcat '=' 6 /min
O08557 BXGT004030 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed - Ddah1 Kcat/Km '=' 51 /mM/min
O94760 BXGT005328 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed Enzyme DDAH1 Kcat/Km '=' 9 /mM/min
O94760 BXGT005328 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed Enzyme DDAH1 Km '=' 350000 nM
O08557 BXGT004030 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed - Ddah1 Kcat '=' 9 /min
P39748 BXGT010134 Flap endonuclease 1 reviewed Enzyme FEN1 Potency - 4228 nM
O94760 BXGT005328 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed Enzyme DDAH1 Kcat/Km '=' 2 /mM/min
O94760 BXGT005328 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed Enzyme DDAH1 Kcat '=' 0 /min
O94760 BXGT005328 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed Enzyme DDAH1 Kcat '=' 1 /min
O94760 BXGT005328 N(G),N(G)-dimethylarginine dimethylaminohydrolase 1 reviewed Enzyme DDAH1 Km - - -
P33261 BXGT009707 Cytochrome P450 2C19 reviewed - CYP2C19 Potency '=' 10000 nM
P15289 BXGT008102 Arylsulfatase A reviewed Enzyme ARSA Potency - 213 nM
O89049 BXGT005293 Thioredoxin reductase 1, cytoplasmic reviewed - Txnrd1 Potency - 1122 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00006 Garden onion Allium cepa Vegetables
BXGF00013 Dill Anethum graveolens Herbs and Spices
BXGF00022 Oat Avena sativa Cereals and cereal products
BXGF00034 Broccoli Brassica oleracea var. italica Vegetables
BXGF00036 Turnip Brassica rapa var. rapa Herbs and Spices
BXGF00065 Cucumber Cucumis sativus Gourds
BXGF00088 Barley Hordeum vulgare Cereals and cereal products
BXGF00129 Parsnip Pastinaca sativa Vegetables
BXGF00162 Red raspberry Rubus idaeus Fruits
BXGF00169 Rye Secale cereale Cereals and cereal products
BXGF00174 Eggplant Solanum melongena Vegetables
BXGF00175 Potato Solanum tuberosum Vegetables
BXGF00178 Spinach Spinacia oleracea Vegetables
BXGF00225 Swiss chard Beta vulgaris ssp. cicla Vegetables
BXGF00230 Carrot Daucus carota ssp. sativus Vegetables
BXGF00246 Red beetroot Beta vulgaris var. rubra Vegetables
BXGF00519 Wheat Triticum Cereals and cereal products
BXGF00819 Pulses Pulses
BXGF00826 Sunburst squash (pattypan squash) Cucurbita pepo var. clypeata Gourds
BXGF00827 Green zucchini Cucurbita pepo var. cylindrica Gourds
BXGF00828 Yellow zucchini Cucurbita pepo var. cylindrica Gourds
BXGF00829 Green bell pepper Capsicum annuum Vegetables
BXGF00830 Yellow bell pepper Capsicum annuum Vegetables
BXGF00831 Orange bell pepper Capsicum annuum Vegetables
BXGF00832 Red bell pepper Capsicum annuum Vegetables
BXGF00834 Yellow wax bean Phaseolus vulgaris Pulses
BXGF00835 Green bean Phaseolus vulgaris Pulses
BXGF00836 Saskatoon berry Amelanchier alnifolia Fruits
BXGF00837 Nanking cherry Prunus tomentosa Fruits
BXGF00838 Japanese pumpkin Cucurbita maxima Gourds
BXGF00839 White cabbage Brassica oleracea L. var. capitata L. f. alba DC. Vegetables
BXGF00840 Romaine lettuce Lactuca sativa L. var. longifolia Vegetables
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