Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | APLNR | P35414 | 1/20 | 0.38 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.37 |
| ▸ | HPD | P32754 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9733850 | 0.92 | ALDH1A1 (0.41) | ALDH1A1CYP2D6CYP2C19POLBKDM4E | |
| SCHEMBL9733701 | 0.90 | ALDH1A1 (0.47) | ALDH1A1CYP2D6CYP2C19POLBKDM4E | |
| SCHEMBL9733604 | 0.89 | ALDH1A1 (0.41) | ALDH1A1CYP2D6CYP2C19POLBKDM4E | |
| SCHEMBL9734002 | 0.89 | MALT1 (0.47) | ALDH1A1CYP2D6CYP2C19POLBKDM4E | |
| SCHEMBL9733424 | 0.88 | ALDH1A1 (0.44) | ALDH1A1CYP2D6CYP2C19POLBKDM4E | |
| SCHEMBL9734019 | 0.88 | ALDH1A1 (0.59) | ALDH1A1CYP2D6CYP2C19POLBKDM4E | |
| SCHEMBL9733299 | 0.88 | ALDH1A1 (0.47) | ALDH1A1CYP2D6CYP2C19POLBKDM4E | |
| SCHEMBL9733487 | 0.88 | MALT1 (0.39) | ALDH1A1CYP2D6CYP2C19POLBKDM4E | |
| SCHEMBL9733292 | 0.87 | MEN1 (0.45) | ALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL9733390 | 0.87 | ALDH1A1 (0.43) | ALDH1A1CYP2D6CYP2C19POLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5124331-A | Anticancer agents | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1992-06-23 | — | — | US | disclosed |
| EP-0364598-A1 | 3,4-dihydrothieno ¬2,3-d pyrimidine compounds and pharmaceutical application thereof | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1990-04-25 | — | — | EP | disclosed |