Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.36 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.36 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | CTSS | P25774 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL12403600 | 0.77 | HTT (0.46) | HTTGAATAAR1NPC1RAB9A | |
| SCHEMBL12417075 | 0.75 | — | — | |
| SCHEMBL862369 | 0.70 | — | — | |
| SCHEMBL6733610 | 0.69 | TAAR1 (0.50) | HTTGAATAAR1NPC1RAB9A | |
| SCHEMBL3593018 | 0.69 | HTT (0.47) | HTTGAATAAR1NPC1RAB9A | |
| SCHEMBL29634825 | 0.69 | HTT (0.43) | HTTGAATAAR1NPC1RAB9A | |
| SCHEMBL8057921 | 0.67 | — | — | |
| SCHEMBL14498979 | 0.67 | TAAR1 (0.48) | HTTTAAR1NPC1RAB9ARIPK1 | |
| SCHEMBL21790520 | 0.67 | HTT (0.41) | HTTGAATAAR1NPC1RAB9A | |
| SCHEMBL23635740 | 0.66 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117142915-A | Method for synthesizing organic peroxy compound by decarboxylation of carboxylic acid under catalysis of visible light | 中国人民大学 | 2023-12-01 | — | — | CN | claimed |
| CN-117142915-A | Method for synthesizing organic peroxy compound by decarboxylation of carboxylic acid under catalysis of visible light | 中国人民大学 | 2023-12-01 | — | — | CN | disclosed |