Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.42 |
| ▸ | HTR2A | P28223 | 9/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL29207990 | 0.95 | KCNH2 (0.39) | HRH3KCNH2HTR2ACYP1A2CYP2C19 | |
| SCHEMBL30842099 | 0.92 | HTR2A (0.42) | HRH3KCNH2HTR2ACYP1A2CYP2C19 | |
| SCHEMBL30832020 | 0.88 | ALDH1A1 (0.42) | HRH3KCNH2HTR2ACYP1A2CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL29208087 | 0.88 | HTR2A (0.41) | HRH3KCNH2HTR2ACYP1A2CYP2C19 | |
| SCHEMBL30842023 | 0.87 | HTR2A (0.41) | HRH3KCNH2HTR2ACYP1A2CYP2C19 | |
| SCHEMBL30831998 | 0.86 | HRH3 (0.42) | HRH3KCNH2HTR2AALDH1A1TSHR | |
| SCHEMBL30832023 | 0.85 | MLLT1 (0.43) | HRH3KCNH2HTR2AALDH1A1TSHR | |
| SCHEMBL30842010 | 0.84 | ALDH1A1 (0.41) | HRH3KCNH2HTR2ACYP1A2CYP2C19 | |
| SCHEMBL30832039 | 0.84 | ALDH1A1 (0.54) | HRH3KCNH2HTR2ACYP1A2CYP2C19 | |
| SCHEMBL30832012 | 0.82 | HTR2A (0.46) | HRH3KCNH2HTR2ATSHRHTR2C |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024067304-A1 | COMPOUND WITH INHIBITORY ACTIVITY AGAINST SIGMA2 AND 5HT2A AND USE | 瀚远医药有限公司 | 2024-04-04 | — | — | WO | disclosed |