Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALPG | P10696 | 1/20 | 0.50 |
| ▸ | PHGDH | O43175 | 1/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Propane SCHEMBL11438051 | 0.97 | ALPG (0.48) | ALPGPHGDHMGLL | |
| SCHEMBL15263698 | 0.97 | ALPG (0.53) | ALPGPHGDHMGLLALDH1A1CYP1A2 | |
| Methane SCHEMBL11821836 | 0.93 | ALPG (0.50) | ALPGPHGDHMGLLALDH1A1CYP1A2 | |
| Isobutane SCHEMBL11441025 | 0.91 | ALPG (0.43) | ALPG | |
| Diethyl Sulfide SCHEMBL11440076 | 0.80 | ALPG (0.36) | ALPGALDH1A1CYP1A2CYP2D6TSHR | |
| Propane SCHEMBL10976581 | 0.78 | ALPG (0.37) | ALPGALDH1A1TSHR | |
| Methylsulfanylmethane SCHEMBL11439815 | 0.78 | ALPG (0.44) | ALPG | |
| Propane SCHEMBL10717936 | 0.78 | ALPG (0.37) | ALPGALDH1A1TSHR | |
| Propane SCHEMBL11872178 | 0.78 | ALPG (0.37) | ALPGALDH1A1TSHR | |
| Propane SCHEMBL11444685 | 0.77 | ALPG (0.42) | ALPGNOS3NOS1NOS2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117607429-A | Preparation method of sample for detecting residual methamphetamine in fruits and vegetables | 深圳市卓润生物科技有限公司 | 2024-02-27 | — | — | CN | disclosed |
| CN-110831584-B | Targeted drug rescue with novel compositions, combinations and methods thereof | 埃克塞瓦有限责任公司 | 2023-03-10 | — | — | CN | disclosed |
| CN-110831584-A | Targeted drug rescue with novel compositions, combinations and methods thereof | 埃克塞瓦有限责任公司 | 2020-02-21 | — | — | CN | disclosed |
| US-5093358-A | MACROCYCLIC PLANT ACARICIDES | CIBA-GEIGY CORP. (US) | 1992-03-03 | — | — | US | disclosed |