Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.49 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | GLS | O94925 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1787317 | 0.86 | MAOB (0.56) | MAOBMEN1CYP1A2CHRM2CYP2C19 | |
| SCHEMBL7524646 | 0.86 | KEAP1 (0.60) | ALDH1A1KEAP1NFE2L2TLR9MAOB | |
| SCHEMBL29596524 | 0.86 | KEAP1 (0.60) | ALDH1A1KEAP1NFE2L2TLR9MAOB | |
| SCHEMBL15293799 | 0.85 | MAOB (0.59) | MAOBMEN1CYP1A2CHRM2CYP2C19 | |
| SCHEMBL3469500 | 0.83 | MAOB (0.60) | MAOBMEN1CYP1A2CHRM2CYP2C19 | |
| SCHEMBL29263672 | 0.83 | MAOB (0.60) | MAOBMEN1CYP1A2CHRM2CYP2C19 | |
| SCHEMBL20099096 | 0.83 | MAOB (0.60) | MAOBMEN1CYP1A2CHRM2CYP2C19 | |
| SCHEMBL3468557 | 0.83 | MAOB (0.60) | MAOBMEN1CYP1A2CHRM2CYP2C19 | |
| SCHEMBL4578721 | 0.82 | ALDH1A1 (0.51) | ALDH1A1MAOBGLS | |
| SCHEMBL21561543 | 0.82 | ALDH1A1 (0.46) | ALDH1A1MAOBCHRM2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11161102-B2 | Iminium salt organocatalysts, method of making, and methods of using | UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) | 2021-11-02 | — | — | US | disclosed |
| US-20190344253-A1 | IMINIUM SALT ORGANOCATALYSTS, METHOD OF MAKING, AND METHODS OF USING | UNIV VIRGINIA PATENT FOUNDATION (US) | 2019-11-14 | — | — | US | disclosed |
| WO-2017223287-A1 | IMINIUM SALT ORGANOCATALYSTS, METHODS OF MAKING, AND METHODS OF USING | UNIVERSITY OF VIRGINIA (US) | 2017-12-28 | — | — | WO | disclosed |