Compound Description
| ID: C0442 | Common name: Theobromine |
| IUPAC: 3,7-dimethylpurine-2,6-dione | CAS: CAS:83-67-0 |
| Chembl ID: CHEMBL1114 | Pubchem ID: CID:5429 |
| Formula: C7H8N4O2 | TCM-ID: TCMC2156 |
| Smiles: CN1C=NC2=C1C(=O)NC(=O)N2C | |
| Alias:
Theobromine;
3,7-Dihydro-3,7-dimethyl-1H-purine-2,6-dione; 3,7-Dimethyl-3,7-dihydro-1H-purine-2,6-dione; 3,7-Dimethylxanthine; Diurobromine; NSC 5039; SC 15090; Santheose; Teobromin; Theosalvose; Theostene; Thesal |
Structure:
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Related Targets (Total: 2)
| Target id | Protein Name | Gene Symbol | Uniprot ID | Target Level | No.of Literature Evidence |
|---|---|---|---|---|---|
| T73LPO | Poly [ADP-ribose] polymerase 1 | PARP1 |
P09874 |
A | 1 Reference(s) |
| T58J2Y | Peroxisome proliferator-activated receptor gamma | PPARG |
P37231 |
A | 1 Reference(s) |
*In this table, target level represents the quality confidence indicators of targets.
Level 'A' represents "Directly inhibit/activate".
Level 'B' represents "Indirectly inhibit/ activate", "Enzyme substate" and "Enzyme product".
Level 'C' represents "Up/Down regulation" and "Others".
Level 'A' represents "Directly inhibit/activate".
Level 'B' represents "Indirectly inhibit/ activate", "Enzyme substate" and "Enzyme product".
Level 'C' represents "Up/Down regulation" and "Others".
Related Herbs (Total: 6)
| Herb id | Chinese Pin Yin | Chinese Character | English Name | Latin Name |
|---|---|---|---|---|
| H0615 | Wu Zhi Mao Tao | 五指毛桃 | five-finger fig root | Ficus simplicissima |
| H0847 | Zi He Che | 紫河车 | Human placenta | Homo sapiens |
| H1004 | Bai Cha | 白茶 | White tea | Camellia sinensis |
| H0637 | Cha Ye | 茶叶 | Common tea | Camellia sinensis |
| H1212 | Hu Ye Gan Jin Gao | 槲叶干浸膏 | NA | Quercus dentata |
| H0360 | Ren Zhong Bai | 人中白 | Human urine sediment | Homo sapiens |
Ckey description of the interaction between compound and target