Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.55 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | SLC2A1 | P11166 | 8/20 | 0.51 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MITF | O75030 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 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 | |
|---|---|---|---|---|
| SCHEMBL6428181 | 0.84 | CYP1A2 (0.65) | ALDH1A1SLC2A1CA12CA1CA2 | |
| SCHEMBL31349207 | 0.82 | SLC2A1 (0.59) | PKMALDH1A1SLC2A1CA12CA1 | |
| SCHEMBL31349282 | 0.80 | ALDH1A1 (0.52) | PKMALDH1A1SLC2A1CA12CA1 | |
| SCHEMBL6650793 | 0.78 | ALDH1A1 (0.71) | PKMSLC6A7ALDH1A1CA12CA1 | |
| SCHEMBL31349264 | 0.78 | POLB (0.51) | PKMSLC6A7CA12CA1CA2 | |
| SCHEMBL31349209 | 0.76 | MEN1 (0.64) | ALDH1A1SLC2A1CYP1A2CYP2C19 | |
| SCHEMBL5232026 | 0.75 | SLC6A7 (0.68) | PKMSLC6A7ALDH1A1CA12CA1 | |
| SCHEMBL8356355 | 0.74 | PKM (0.91) | PKMSLC6A7ALDH1A1CA12CA1 | |
| SCHEMBL31349326 | 0.74 | ALDH1A1 (0.66) | PKMALDH1A1SLC2A1CA12CA1 | |
| SCHEMBL31349259 | 0.74 | ALDH1A1 (0.67) | ALDH1A1SLC2A1CYP1A2CYP2C19MITF |
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 |
|---|---|---|---|---|---|---|---|
| EP-4743446-A1 | NITRO-CONTAINING COMPOUNDS THAT KILL MYCOBACTERIA | Board of Trustees of Michigan State University (US) | 2026-05-20 | — | — | EP | disclosed |
| WO-2025015066-A1 | NITRO-CONTAINING COMPOUNDS THAT KILL MYCOBACTERIA | BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) | 2025-01-16 | — | — | WO | disclosed |