Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.46 |
| ▸ | MAPT | P10636 | 9/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GSK3A | P49840 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11103522 | 0.97 | ALDH1A1 (0.47) | ALDH1A1MAPTHSD17B10POLBGAA | |
| Hydrochloric Acid SCHEMBL31396653 | 0.94 | ALDH1A1 (0.46) | ALDH1A1MAPTHSD17B10POLBGAA | |
| SCHEMBL31296679 | 0.85 | ALDH1A1 (0.41) | ALDH1A1MAPTHSD17B10POLBGAA | |
| SCHEMBL9945739 | 0.69 | — | — | |
| SCHEMBL22230024 | 0.69 | — | — | |
| SCHEMBL14698399 | 0.68 | ALDH1A1 (0.40) | ALDH1A1MAPTHSD17B10POLBGAA | |
| Iodide SCHEMBL28191427 | 0.67 | — | — | |
| SCHEMBL20414330 | 0.65 | — | — | |
| SCHEMBL21990409 | 0.64 | — | — | |
| SCHEMBL21990407 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-119462503-A | Synthesis method of (tetrahydro) quinoline compound or (tetrahydro) isoquinoline compound | 中国科学院大连化学物理研究所 | 2025-02-18 | — | — | CN | claimed |
| CN-116135867-B | Method for preparing pyridine ferrocene compound | 中国科学院大连化学物理研究所 | 2025-03-18 | — | — | CN | disclosed |