Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 5/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | TDO2 | P48775 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30584640 | 1.00 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1MAPTLMNATP53 | |
| SCHEMBL29092100 | 0.79 | MGLL (0.40) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL30584646 | 0.79 | MGLL (0.40) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL30584635 | 0.79 | IDO1 (0.49) | ALDH1A1L3MBTL1MAPTLMNAIDO1 | |
| SCHEMBL29092867 | 0.79 | IDO1 (0.49) | ALDH1A1L3MBTL1MAPTLMNAIDO1 | |
| SCHEMBL29092634 | 0.78 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1MAPTLMNATP53 | |
| SCHEMBL29092087 | 0.77 | SMN1; SMN2 (0.44) | ALDH1A1L3MBTL1MAPTLMNATP53 | |
| SCHEMBL30584636 | 0.76 | CYP1A2 (0.55) | ALDH1A1L3MBTL1MAPTLMNACYP1A2 | |
| SCHEMBL29092095 | 0.76 | CYP1A2 (0.55) | ALDH1A1L3MBTL1MAPTLMNACYP1A2 | |
| SCHEMBL12530453 | 0.75 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1MAPTLMNATP53 |
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-116751172-A | Synthesis method of diiodinated 1,2, 3-triazole compound | 海南师范大学 | 2023-09-15 | — | — | CN | disclosed |