Component ID |
TCMH2315 |
Latin Name |
Arnebia euchroma |
English Name |
Arnebia root |
Chinese Pinyin Name |
Xin Jiang Zi Cao |
中文名 |
新疆紫草 |
TCM Properties |
|
TCM Meridians |
|
Therapeutic Class English |
|
Therapeutic Class Chinese |
|
Functions |
|
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
NA |
Reference |
Chinese Pharmacopoeia (2015) |
Barcode ID |
ITSAH4976-14 |
Barcode Source |
BOLDSYSTEMS |
Prescription ID | Prescription English Name | Prescription Chinese Name |
---|---|---|
TCMFx244 | Xiao Er Fei Re Ping Capsule | 小儿肺热平胶囊 |
Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
---|---|---|---|---|
TCMT1 | EHMT2 | Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 | Transferase | Q96KQ7 |
TCMT100 | TTR | Transthyretin | Unclassified | P02766 |
TCMT101 | PTPN1 | Protein-tyrosine phosphatase 1B | Hydrolase | P18031 |
TCMT125 | GBA | Beta-glucocerebrosidase | Hydrolase | P04062 |
TCMT13 | APEX1 | DNA-(apurinic or apyrimidinic site) lyase | Lyase | P27695 |
TCMT133 | CA1 | Carbonic anhydrase I | Lyase | P00915 |
TCMT134 | CA2 | Carbonic anhydrase II | Lyase | P00918 |
TCMT136 | CA12 | Carbonic anhydrase XII | Lyase | O43570 |
TCMT138 | CA7 | Carbonic anhydrase VII | Lyase | P43166 |
TCMT142 | CA4 | Carbonic anhydrase IV | Lyase | P22748 |
TCMT150 | RORC | Nuclear receptor ROR-gamma | Nuclear receptor | P51449 |
TCMT156 | CYP19A1 | Cytochrome P450 19A1 | Oxidoreductase | P11511 |
TCMT162 | UGT1A1 | UDP-glucuronosyltransferase 1-1 | Transferase | P22309 |
TCMT17 | POLB | DNA polymerase beta | Transferase | P06746 |
TCMT176 | SOAT1 | Acyl coenzyme A:cholesterol acyltransferase 1 | Transferase | P35610 |
TCMT18 | GAA | Lysosomal alpha-glucosidase | Hydrolase | P10253 |
TCMT186 | MAOB | Monoamine oxidase B | Oxidoreductase | P27338 |
TCMT187 | AR | Androgen Receptor | Nuclear receptor | P10275 |
TCMT2 | MAPT | Microtubule-associated protein tau | Unclassified | P10636 |
TCMT206 | CYP2A6 | Cytochrome P450 2A6 | Oxidoreductase | P11509 |
TCMT208 | MAOA | Monoamine oxidase A | Oxidoreductase | P21397 |
TCMT248 | CXCL8 | Interleukin-8 | Unclassified | P10145 |
TCMT263 | SOAT2 | Acyl coenzyme A:cholesterol acyltransferase 2 | Transferase | O75908 |
TCMT289 | TBXAS1 | Thromboxane-A synthase | Isomerase | P24557 |
TCMT295 | MMP1 | Matrix metalloproteinase-1 | Hydrolase | P03956 |
TCMT297 | FABP4 | Fatty acid binding protein adipocyte | Unclassified | P15090 |
TCMT298 | FABP3 | Fatty acid binding protein muscle | Hydrolase | P05413 |
TCMT31 | CYP2C19 | Cytochrome P450 2C19 | Oxidoreductase | P33261 |
TCMT33 | CYP3A4 | Cytochrome P450 3A4 | Oxidoreductase | P08684 |
TCMT336 | IDO1 | Indoleamine 2,3-dioxygenase | Oxidoreductase | P14902 |
TCMT359 | FYN | Tyrosine-protein kinase FYN | Kinase | P06241 |
TCMT39 | PDE5A | Phosphodiesterase 5A | Hydrolase | O76074 |
TCMT45 | APP | Beta amyloid A4 protein | Unclassified | P05067 |
TCMT479 | AKT1 | Serine/threonine-protein kinase AKT | Kinase | P31749 |
TCMT558 | TOP2A | DNA topoisomerase II alpha | Isomerase | P11388 |
TCMT563 | CDC25B | Dual specificity phosphatase Cdc25B | Hydrolase | P30305 |
TCMT61 | MCL1 | Induced myeloid leukemia cell differentiation protein Mcl-1 | Unclassified | Q07820 |
TCMT63 | PPARA | Peroxisome proliferator-activated receptor alpha | Nuclear receptor | Q07869 |
TCMT64 | PPARD | Peroxisome proliferator-activated receptor delta | Nuclear receptor | Q03181 |
TCMT67 | PPARG | Peroxisome proliferator-activated receptor gamma | Nuclear receptor | P37231 |
TCMT69 | THRB | Thyroid hormone receptor beta-1 | Nuclear receptor | P10828 |
TCMT8 | KDM4E | Lysine-specific demethylase 4D-like | Oxidoreductase | B2RXH2 |
TCMT80 | MAPK1 | MAP kinase ERK2 | Kinase | P28482 |
TCMT808 | FABP5 | Fatty acid binding protein epidermal | Unclassified | Q01469 |
TCMT809 | FABP2 | Fatty acid binding protein intestinal | Unclassified | P12104 |
TCMT810 | TLR2 | Toll-like receptor 2 | Unclassified | O60603 |
TCMT82 | ESR1 | Estrogen receptor alpha | Nuclear receptor | P03372 |
TCMT87 | CYP2C9 | Cytochrome P450 2C9 | Oxidoreductase | P11712 |
TCMT95 | MPG | DNA-3-methyladenine glycosylase | Hydrolase | P29372 |
Target ID | Target Name |
---|---|
TCMT1090 | Human immunodeficiency virus type 1 integrase |
TCMT1108 | Integrase |
TCMT1214 | Enterococcus faecium |
TCMT1218 | Staphylococcus aureus |
TCMT1223 | Staphylococcus epidermidis |
TCMT1229 | Enterococcus faecalis |
TCMT1232 | Pseudomonas aeruginosa |
TCMT1245 | Phytophthora cactorum |
TCMT1246 | Escherichia coli |
TCMT1251 | Candida albicans |
TCMT1253 | Penicillium chrysogenum |
TCMT1255 | Human immunodeficiency virus 1 |
TCMT1361 | Neisseria meningitidis |
TCMT1382 | Plasmodium falciparum (isolate K1 / Thailand) |
TCMT1408 | Colletotrichum gloeosporioides |
TCMT1438 | Plasmodium falciparum |
TCMT1442 | Leishmania donovani |
TCMT1454 | Bacillus subtilis |
TCMT1462 | Streptococcus mutans |
TCMT1463 | Mycobacterium tuberculosis |
Ingredient ID: TCMC999
Formula: C10H20O2
Ingredient ID: TCMC915
Formula: C9H8O
Ingredient ID: TCMC857
Formula: C10H16O
Ingredient ID: TCMC796
Formula: C21H24O7
Ingredient ID: TCMC696
Formula: C10H12O
Ingredient ID: TCMC624
Formula: C18H18O6
Ingredient ID: TCMC473
Formula: C10H16O
Ingredient ID: TCMC280
Formula: C10H12O
Ingredient ID: TCMC2729
Formula: C21H24O6
Ingredient ID: TCMC2728
Formula: C25H22O6
Ingredient ID: TCMC2727
Formula: C26H22O8
Ingredient ID: TCMC2718
Formula: C21H24O6
Ingredient ID: TCMC2706
Formula: C20H22O6
Ingredient ID: TCMC2692
Formula: C16H16O4
Ingredient ID: TCMC2613
Formula: C30H48O5
Ingredient ID: TCMC2552
Formula: C21H24O6
Ingredient ID: TCMC2547
Formula: C18H18O6
Ingredient ID: TCMC2388
Formula: C21H22O6
Ingredient ID: TCMC2385
Formula: C16H16O5
Ingredient ID: TCMC2381
Formula: C8H10O
Ingredient ID: TCMC2366
Formula: C15H24O
Ingredient ID: TCMC2069
Formula: C16H16O5
Ingredient ID: TCMC2025
Formula: C18H16O8
Ingredient ID: TCMC195
Formula: C19H20O6
Ingredient ID: TCMC192
Formula: C21H24O6
Ingredient ID: TCMC1867
Formula: C14H10
Ingredient ID: TCMC1830
Formula: C16H32O2
Ingredient ID: TCMC1826
Formula: C9H10O3
Ingredient ID: TCMC1730
Formula: C10H6O2
Ingredient ID: TCMC1712
Formula: C15H24O
Ingredient ID: TCMC1578
Formula: C11H14O2
Ingredient ID: TCMC1506
Formula: C27H22O12
Ingredient ID: TCMC1386
Formula: C20H22O6
Ingredient ID: TCMC1197
Formula: C5H4O2
Ingredient ID: TCMC1159
Formula: C10H12O2
Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TCMC192 | C21H24O6 | [(1R)-1-(5,8-Dihydroxy-1,4-Dioxonaphthalen-2-Yl)-4-Methylpent-3-Enyl] 3-Methylbutanoate | 372.16 | 0.9953 | 3.11 | 2.499 | 4 | 2 | 100.9 | 13 | 2 | 27 | 0 |
TCMC195 | C19H20O6 | [(1R)-1-(5,8-Dihydroxy-1,4-Dioxonaphthalen-2-Yl)-4-Methylpent-3-Enyl] Propanoate | 344.13 | 0.4737 | 2.89 | 1.422 | 4 | 2 | 100.9 | 11 | 2 | 25 | 0 |
TCMC280 | C10H12O | 1-Methoxy-4-[(Z)-Prop-1-Enyl]Benzene | 148.09 | 0.8555 | 2.45 | 3.979 | 0 | 0 | 9.23 | 4 | 1 | 11 | 0 |
TCMC473 | C10H16O | 4,7,7-Trimethylbicyclo[2.2.1]Heptan-3-One | 152.12 | 0.9693 | 2.45 | 2.127 | 1 | 0 | 17.07 | 3 | 2 | 11 | 0 |
TCMC624 | C18H18O6 | Acetylshikonin | 330.11 | 0.3975 | 2.78 | 1.169 | 4 | 2 | 100.9 | 10 | 2 | 24 | 0 |
TCMC696 | C10H12O | Anethole | 148.09 | 0.8555 | 2.45 | 3.979 | 0 | 0 | 9.23 | 4 | 1 | 11 | 0 |
TCMC796 | C21H24O7 | Beta-Hydroxyisovalerylshikonin | 388.15 | 0.5562 | 3 | 1.167 | 5 | 3 | 121.13 | 14 | 2 | 28 | 0 |
TCMC857 | C10H16O | Camphor | 152.12 | 0.9693 | 2.45 | 2.127 | 1 | 0 | 17.07 | 3 | 2 | 11 | 0 |
TCMC915 | C9H8O | Cinnamaldehyde | 132.06 | 0.1687 | 2.34 | 3.985 | 1 | 0 | 17.07 | 2 | 1 | 10 | 0 |
TCMC999 | C10H20O2 | Decanoic Acid | 172.15 | -2.1697 | 2.34 | 4.156 | 2 | 1 | 37.3 | 10 | 0 | 12 | 0 |
TCMC1159 | C10H12O2 | Eugenol | 164.08 | 0.5166 | 2.34 | 2.484 | 0 | 1 | 29.46 | 5 | 1 | 12 | 0 |
TCMC1197 | C5H4O2 | Furfural | 96.02 | -0.3465 | 1.79 | 1.057 | 1 | 0 | 30.21 | 1 | 1 | 7 | 0 |
TCMC1386 | C20H22O6 | Isobutylshikonin | 358.14 | 1.1219 | 3 | 1.715 | 4 | 2 | 100.9 | 12 | 2 | 26 | 0 |
TCMC1506 | C27H22O12 | Lithospermic Acid | 538.11 | -2.955 | 3.11 | 1.877 | 6 | 7 | 211.28 | 16 | 4 | 39 | 1 |
TCMC1578 | C11H14O2 | Methyleugenol | 178.1 | 0.9251 | 2.45 | 3.003 | 0 | 0 | 18.46 | 6 | 1 | 13 | 0 |
TCMC1712 | C15H24O | 220.18 | 1.9144 | 3 | 4.607 | 1 | 0 | 12.53 | 3 | 3 | 16 | 0 | |
TCMC1730 | C10H6O2 | Naphthoquinone | 158.04 | -0.2732 | 2.34 | 1.96 | 2 | 0 | 34.14 | 0 | 2 | 12 | 0 |
TCMC1826 | C9H10O3 | Paeonol | 166.06 | -0.766 | 2.12 | 1.32 | 1 | 1 | 46.53 | 5 | 1 | 12 | 0 |
TCMC1830 | C16H32O2 | Palmitic Acid | 256.24 | -3.8977 | 3 | 7.57 | 2 | 1 | 37.3 | 16 | 0 | 18 | 2 |
TCMC1867 | C14H10 | Phenanthrene | 178.08 | 0 | 3 | 7.814 | 0 | 0 | 0 | 0 | 3 | 14 | 1 |
TCMC2025 | C18H16O8 | Rosmarinic Acid | 360.08 | -1.9057 | 2.56 | 2.083 | 4 | 5 | 144.52 | 12 | 2 | 26 | 0 |
TCMC2069 | C16H16O5 | Shikonin | 288.1 | 0.0184 | 2.67 | 0.858 | 3 | 3 | 94.83 | 8 | 2 | 21 | 0 |
TCMC2366 | C15H24O | 220.18 | 1.9144 | 3 | 4.607 | 1 | 0 | 12.53 | 3 | 3 | 16 | 0 | |
TCMC2381 | C8H10O | Phenylethyl Alcohol | 122.07 | -0.1931 | 2.23 | 3.189 | 1 | 1 | 20.23 | 3 | 1 | 9 | 0 |
TCMC2385 | C16H16O5 | Alkannin | 288.1 | 0.0184 | 2.67 | 0.858 | 3 | 3 | 94.83 | 8 | 2 | 21 | 0 |
TCMC2388 | C21H22O6 | Beta,Beta-Dimethylacrylalkannin | 370.14 | 1.8371 | 3.11 | 2.047 | 4 | 2 | 100.9 | 12 | 2 | 27 | 0 |
TCMC2547 | C18H18O6 | Acetylalkannin | 330.11 | 0.3975 | 2.78 | 1.169 | 4 | 2 | 100.9 | 10 | 2 | 24 | 0 |
TCMC2552 | C21H24O6 | (S)-Alpha-Methylbutyryl Alkannin | 372.16 | 0.4457 | 3.11 | 2.284 | 4 | 2 | 100.9 | 13 | 2 | 27 | 0 |
TCMC2613 | C30H48O5 | Tomentic Acid | 488.35 | 0.822 | 4.21 | 5.966 | 5 | 4 | 97.99 | 12 | 5 | 35 | 1 |
TCMC2692 | C16H16O4 | Deoxyshikonin | 272.1 | 0.5915 | 2.78 | 1.615 | 2 | 2 | 74.6 | 7 | 2 | 20 | 0 |
TCMC2706 | C20H22O6 | Isobutylalkannin | 358.14 | 1.1219 | 3 | 1.715 | 4 | 2 | 100.9 | 12 | 2 | 26 | 0 |
TCMC2718 | C21H24O6 | Isovaleryl Alkannin | 372.16 | 0.9953 | 3.11 | 2.499 | 4 | 2 | 100.9 | 13 | 2 | 27 | 0 |
TCMC2727 | C26H22O8 | 3,4-(Methylenedioxy)Cinnamoyl Alkannin | 462.13 | 0.446 | 3.44 | 2.926 | 4 | 2 | 119.36 | 11 | 4 | 34 | 0 |
TCMC2728 | C25H22O6 | Cinnamoyl Alkannin | 418.14 | 0.7487 | 3.55 | 5.153 | 4 | 2 | 100.9 | 11 | 3 | 31 | 1 |
TCMC2729 | C21H24O6 | (R)-Alpha-Methylbutyryl Alkannin | 372.16 | 0.4457 | 3.11 | 2.284 | 4 | 2 | 100.9 | 13 | 2 | 27 | 0 |