Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | CDC25B | P30305 | 4/20 | 0.54 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | FADS1 | O60427 | 1/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.49 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL18655633 | 0.92 | CDC25B (0.51) | ALDH1A1CDC25BHPGDTP53CYP3A4 | |
| SCHEMBL24958589 | 0.91 | CDC25B (0.47) | ALDH1A1CDC25BHPGDTP53CYP3A4 | |
| SCHEMBL26157627 | 0.91 | CDC25B (0.50) | ALDH1A1CDC25BHPGDTP53CYP3A4 | |
| SCHEMBL26492114 | 0.88 | ALDH1A1 (0.51) | ALDH1A1CDC25BHPGDTP53CYP3A4 | |
| SCHEMBL24816065 | 0.88 | ALDH1A1 (0.54) | ALDH1A1CDC25BHPGDTP53CYP3A4 | |
| SCHEMBL30767839 | 0.88 | ALDH1A1 (0.54) | ALDH1A1CDC25BHPGDTP53CYP3A4 | |
| SCHEMBL29772965 | 0.87 | ALDH1A1 (0.58) | ALDH1A1CDC25BHPGDTP53CYP3A4 | |
| SCHEMBL4054971 | 0.87 | ALDH1A1 (0.58) | ALDH1A1CDC25BHPGDTP53CYP3A4 | |
| SCHEMBL17742371 | 0.87 | CDC25B (0.72) | ALDH1A1CDC25BHPGDTP53CYP3A4 | |
| SCHEMBL31440468 | 0.87 | ALDH1A1 (0.71) | ALDH1A1CDC25BHPGDTP53CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023287252-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2023-01-19 | — | — | WO | disclosed |