Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 6/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.65 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | HTR2B | P41595 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.60 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.58 |
| ▸ | DRD2 | P14416 | 2/20 | 0.55 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.53 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.51 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.51 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.50 |
| ▸ | CTSK | P43235 | 1/20 | 0.50 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Tetrahydroharman SCHEMBL21012020 | 1.00 | HTR7 (0.65) | HTR7CYP3A4CYP2D6CYP2C19MAPT | |
| Tetrahydroharman SCHEMBL7018798 | 1.00 | HTR7 (0.65) | HTR7CYP3A4CYP2D6CYP2C19MAPT | |
| Tetrahydroharman SCHEMBL29630308 | 1.00 | HTR7 (0.65) | HTR7CYP3A4CYP2D6CYP2C19MAPT | |
| SCHEMBL24428198 | 0.90 | BRD3 (0.55) | HTR7CYP3A4CYP2D6CYP2C19MAPT | |
| Tetrahydroharman SCHEMBL28697145 | 0.83 | MAPT (0.48) | HTR7CYP3A4CYP2D6CYP2C19MAPT | |
| SCHEMBL17839824 | 0.80 | HTR7 (0.65) | HTR7CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL9956719 | 0.80 | HTR7 (0.65) | HTR7CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL968830 | 0.80 | HTR7 (0.65) | HTR7CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL12212162 | 0.80 | HTR7 (0.65) | HTR7CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL21326157 | 0.80 | HTR7 (0.60) | HTR7CYP3A4CYP2D6CYP2C19MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113616646-B | Application of carboline alkaloid in preparation of anti-UVB radiation preparation | 中国科学院昆明植物研究所 | 2024-04-02 | — | — | CN | disclosed |
| WO-2023234965-A9 | METHOD AND SYSTEM TO IDENTIFY NATURAL PRODUCTS FROM MASS SPECTROMETRY AND GENOMICS DATA | CARNEGIE MELLON UNIVERSITY (US) | 2024-03-28 | — | — | WO | disclosed |
| WO-2023234965-A2 | METHOD AND SYSTEM TO IDENTIFY NATURAL PRODUCTS FROM MASS SPECTROMETRY AND GENOMICS DATA | CARNEGIE MELLON UNIVERSITY (US) | 2023-12-07 | — | — | WO | disclosed |
| US-20230282311-A1 | METHOD AND SYSTEM TO IDENTIFY NATURAL PRODUCTS FROM MASS SPECTROMETRY AND GENOMICS DATA | UNITED STATES DEPARTMENT OF ENERGY | 2023-09-07 | — | — | US | disclosed |
| CN-115060822-A | Fingerprint spectrum quantitative analysis method based on Chinese medicine imprinting template component cluster | 湖南中医药大学 | 2022-09-16 | — | — | CN | disclosed |
| EP-3459950-B1 | TETRAHYDRO-BETA-CARBOLINE ALKALOID DERIVATIVES, METHOD FOR PREPARING THE SAME AND USE IN ASPECTS OF PREVENTING AND TREATING PLANT VIRUSES, AS FUNGICIDES AND INSECTICIDES | JINGBO AGROCHEMICALS TECH CO LTD (CN) | 2022-05-18 | — | — | EP | disclosed |
| EP-3459951-B1 | TETRAHYDRO-BETA-CARBOLINE ALKALOID DERIVATIVES, METHOD FOR PREPARING THE SAME AND USE IN ASPECTS OF PREVENTING AND TREATING PLANT VIRUSES, AS FUNGICIDES AND INSECTICIDES | JINGBO AGROCHEMICALS TECH CO LTD (CN) | 2022-05-11 | — | — | EP | disclosed |