Component ID |
TCMH314 |
Latin Name |
Ailanthus altissima |
English Name |
Ailanthus bark, tree of heaven bark |
Chinese Pinyin Name |
Chun Gen Pi |
中文名 |
椿根皮 |
TCM Properties |
Cool,Bitter,Punkery |
TCM Meridians |
|
Therapeutic Class English |
Heat clearence |
Therapeutic Class Chinese |
清热 |
Functions |
remove damp-heat and arrest discharges |
Toxicity |
NA |
Geo-authentic habitats (道地产区) |
NA |
Reference |
Chinese Pharmacopoeia (2015) |
Barcode ID |
ITSAM1596-14 |
Barcode Source |
BOLDSYSTEMS |
Target ID | Gene Symbol | Target Name | Target Class | Uniprot ID |
---|---|---|---|---|
TCMT101 | PTPN1 | Protein-tyrosine phosphatase 1B | Hydrolase | P18031 |
TCMT133 | CA1 | Carbonic anhydrase I | Lyase | P00915 |
TCMT134 | CA2 | Carbonic anhydrase II | Lyase | P00918 |
TCMT135 | CA14 | Carbonic anhydrase XIV | Lyase | Q9ULX7 |
TCMT136 | CA12 | Carbonic anhydrase XII | Lyase | O43570 |
TCMT137 | CA9 | Carbonic anhydrase IX | Lyase | Q16790 |
TCMT138 | CA7 | Carbonic anhydrase VII | Lyase | P43166 |
TCMT139 | CA6 | Carbonic anhydrase VI | Lyase | P23280 |
TCMT140 | CA5B | Carbonic anhydrase VB | Lyase | Q9Y2D0 |
TCMT141 | CA5A | Carbonic anhydrase VA | Lyase | P35218 |
TCMT142 | CA4 | Carbonic anhydrase IV | Lyase | P22748 |
TCMT143 | CA3 | Carbonic anhydrase III | Lyase | P07451 |
TCMT156 | CYP19A1 | Cytochrome P450 19A1 | Oxidoreductase | P11511 |
TCMT159 | TYR | Tyrosinase | Oxidoreductase | P14679 |
TCMT160 | HTR7 | Serotonin 7 (5-HT7) receptor | GPCR | P34969 |
TCMT161 | HCAR2 | Hydroxycarboxylic acid receptor 2 | GPCR | Q8TDS4 |
TCMT162 | UGT1A1 | UDP-glucuronosyltransferase 1-1 | Transferase | P22309 |
TCMT166 | AKR1C2 | Aldo-keto reductase family 1 member C2 | Oxidoreductase | P52895 |
TCMT167 | AKR1C3 | Aldo-keto-reductase family 1 member C3 | Oxidoreductase | P42330 |
TCMT168 | AKR1C4 | Aldo-keto reductase family 1 member C4 | Oxidoreductase | P17516 |
TCMT17 | POLB | DNA polymerase beta | Transferase | P06746 |
TCMT2 | MAPT | Microtubule-associated protein tau | Unclassified | P10636 |
TCMT223 | AKR1B1 | Aldose reductase | Oxidoreductase | P15121 |
TCMT236 | ESR2 | Estrogen receptor beta | Nuclear receptor | Q92731 |
TCMT280 | AKR1B10 | Aldo-keto reductase family 1 member B10 | Oxidoreductase | O60218 |
TCMT281 | DPP4 | Dipeptidyl peptidase IV | Unclassified | P27487 |
TCMT423 | EGFR | Epidermal growth factor receptor erbB1 | Kinase | P00533 |
TCMT45 | APP | Beta amyloid A4 protein | Unclassified | P05067 |
TCMT64 | PPARD | Peroxisome proliferator-activated receptor delta | Nuclear receptor | Q03181 |
TCMT8 | KDM4E | Lysine-specific demethylase 4D-like | Oxidoreductase | B2RXH2 |
TCMT82 | ESR1 | Estrogen receptor alpha | Nuclear receptor | P03372 |
Target ID | Target Name |
---|---|
TCMT1175 | Human immunodeficiency virus |
TCMT1212 | Verticillium dahliae |
TCMT1218 | Staphylococcus aureus |
TCMT1251 | Candida albicans |
TCMT1253 | Penicillium chrysogenum |
TCMT1286 | Bacillus cereus |
TCMT1438 | Plasmodium falciparum |
TCMT1454 | Bacillus subtilis |
TCMT1462 | Streptococcus mutans |
TCMT1465 | Entamoeba histolytica |
Ingredient ID: TCMC948
Formula: C9H8O3
Ingredient ID: TCMC865
Formula: C14H8N2O
Ingredient ID: TCMC579
Formula: C7H14O6
Ingredient ID: TCMC2791
Formula: C25H32O9
Ingredient ID: TCMC2790
Formula: C20H24O7
Ingredient ID: TCMC2740
Formula: C25H36O10
Ingredient ID: TCMC2720
Formula: C20H26O7
Ingredient ID: TCMC2660
Formula: C11H20O
Ingredient ID: TCMC2659
Formula: C15H10N2O2
Ingredient ID: TCMC2222
Formula: C8H8O4
Ingredient ID: TCMC2117
Formula: C22H26O8
Ingredient ID: TCMC1839
Formula: C7H6O3
Ingredient ID: TCMC150
Formula: C13H9NO3S
Ingredient ID: TCMC1323
Formula: C6H12O2
Ingredient ID: TCMC125
Formula: C30H50O4
Ingredient ID: TCMC1173
Formula: C10H10O4
Ingredient ID | Formulae | Name | MW | AlogP | MlogP | XlogP | # HBA | # HBD | PSA | # Rotatable Bond | # Ring | # Heacy Atom | Lipinski RO5 Violation |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TCMC125 | C30H50O4 | (5R,9R,10R,13S,14S,17S)-4,4,10,13,14-Pentamethyl-17-[(2S,4R,5S)-4,5,6-Trihydroxy-6-Methylheptan-2-Yl]-1,2,5,6,9,11,12,15,16,17-Decahydrocyclopenta[A]Phenanthren-3-One | 474.37 | 1.7401 | 4.32 | 6.758 | 4 | 3 | 77.76 | 16 | 4 | 34 | 1 |
TCMC150 | C13H9NO3S | (E)-1-(4-Nitrophenyl)-3-Thiophen-2-Ylprop-2-En-1-One | 259.03 | 1.348 | 2.34 | 4.223 | 1 | 0 | 88.45 | 5 | 2 | 18 | 0 |
TCMC579 | C7H14O6 | 6-Methoxycyclohexane-1,2,3,4,5-Pentol | 194.08 | -2.6557 | 1.57 | -1.797 | 6 | 5 | 110.38 | 7 | 1 | 13 | 0 |
TCMC865 | C14H8N2O | Canthin-6-One | 220.06 | -0.2737 | 2.67 | 2.809 | 3 | 0 | 34.89 | 0 | 4 | 17 | 0 |
TCMC948 | C9H8O3 | Coumaric Acid | 164.05 | -0.339 | 2.12 | 1.886 | 2 | 2 | 57.53 | 4 | 1 | 12 | 0 |
TCMC1173 | C10H10O4 | Ferulic Acid | 194.06 | -0.3908 | 2.12 | 1.231 | 2 | 2 | 66.76 | 6 | 1 | 14 | 0 |
TCMC1323 | C6H12O2 | Hexanoate | 116.08 | -1.0177 | 1.9 | 1.88 | 2 | 1 | 37.3 | 6 | 0 | 8 | 0 |
TCMC1839 | C7H6O3 | Paraben | 138.03 | -0.7001 | 1.9 | 1.07 | 2 | 2 | 57.53 | 3 | 1 | 10 | 0 |
TCMC2117 | C22H26O8 | Syringaresinol | 418.16 | -2.1258 | 3 | 0.796 | 2 | 2 | 95.84 | 12 | 4 | 30 | 0 |
TCMC2222 | C8H8O4 | Vanillic Acid | 168.04 | -0.7519 | 1.9 | 0.626 | 2 | 2 | 66.76 | 5 | 1 | 12 | 0 |
TCMC2659 | C15H10N2O2 | 250.07 | -0.3255 | 2.67 | 2.365 | 3 | 0 | 44.12 | 2 | 4 | 19 | 0 | |
TCMC2660 | C11H20O | (E)-2-Undecenal | 168.15 | -1.2524 | 2.56 | 4.695 | 1 | 0 | 17.07 | 9 | 0 | 12 | 0 |
TCMC2720 | C20H26O7 | Chaparrinone | 378.17 | -1.2786 | 2.89 | 0.226 | 7 | 3 | 113.29 | 6 | 5 | 27 | 0 |
TCMC2740 | C25H36O10 | Glaucarubin | 496.23 | -2.1375 | 3.11 | 0.166 | 10 | 5 | 162.98 | 14 | 5 | 35 | 0 |
TCMC2790 | C20H24O7 | Ailanthone | 376.15 | -0.9967 | 2.89 | -0.429 | 7 | 3 | 113.29 | 5 | 5 | 27 | 0 |
TCMC2791 | C25H32O9 | 476.2 | -0.322 | 3.22 | 0.933 | 9 | 3 | 139.59 | 11 | 5 | 34 | 0 |