Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10425804 | 0.79 | ALDH1A1 (0.52) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL22990621 | 0.77 | KIF11 (0.32) | ALDH1A1TSHRKDM4EGLAPOLB | |
| SCHEMBL2513921 | 0.77 | HSD17B10 (0.46) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL1603439 | 0.75 | PTPN22 (0.54) | ALDH1A1HSD17B10HPGDTSHRKDM4E | |
| SCHEMBL3704184 | 0.75 | CYP2A6 (0.54) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL9369941 | 0.75 | TSHR (0.54) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL7308996 | 0.75 | ALDH1A1 (0.44) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL15707951 | 0.75 | ESR1 (0.40) | F12 | |
| SCHEMBL29620304 | 0.74 | KIF11 (0.36) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 | |
| SCHEMBL6313808 | 0.74 | KIF11 (0.36) | ALDH1A1HSD17B10HPGDTSHRCYP3A4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4519361-A1 | DYES FOR MONITORING CELL STATES | Sunnybrook Research Institute (CA) | 2025-03-12 | — | — | EP | disclosed |
| WO-2023212818-A1 | DYES FOR MONITORING CELL STATES | Sunnybrook Research Institute (CA) | 2023-11-09 | — | — | WO | disclosed |
| CN-104884453-B | Anthelmintic compounds and compositions and methods of using the same | 梅里亚股份有限公司 | 2018-06-22 | — | — | CN | disclosed |
| CN-106536518-A | Anthelmintic compounds | 梅里亚股份有限公司 | 2017-03-22 | — | — | CN | disclosed |
| US-4331613-A | Process for the preparation of trifluoromethylnaphthalenes | BAYER AKTIENGESELLSCHAFT (DE) | 1982-05-25 | — | — | US | disclosed |