Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 11/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL9334395 | 0.85 | ALDH1A1 (0.46) | ALDH1A1TSHRNAPRTTDP1 | |
| SCHEMBL29906330 | 0.85 | — | — | |
| SCHEMBL50061 | 0.85 | — | — | |
| Ethylene SCHEMBL28761744 | 0.83 | NFE2L2 (0.59) | NFE2L2ALDH1A1LMNAGRIN2DGRIN3B | |
| Methane SCHEMBL11859929 | 0.83 | NFE2L2 (0.59) | NFE2L2ALDH1A1LMNAGRIN2DGRIN3B | |
| Water SCHEMBL27875439 | 0.83 | NFE2L2 (0.59) | NFE2L2ALDH1A1LMNAGRIN2DGRIN3B | |
| Pyridine SCHEMBL28193400 | 0.78 | TSHR (0.53) | NFE2L2TSHRNAPRTTDP1 | |
| SCHEMBL23044749 | 0.77 | NFE2L2 (0.52) | NFE2L2ALDH1A1GRIN2DGRIN3BGRIN1 | |
| Pyridine SCHEMBL28432996 | 0.76 | KMT2A (0.52) | ALDH1A1LMNATSHRNAPRTTDP1 | |
| Styrene SCHEMBL28210140 | 0.76 | ALDH1A1 (0.56) | ALDH1A1TSHRNAPRTTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109705027-B | 1, 2-di (pyridyl) -3, 4-di (4-pyridylvinyl-3-fluorobenzene) cyclobutane and preparation method thereof | 广西民族大学 | 2022-05-31 | — | — | CN | disclosed |