Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.39 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.39 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.39 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9525489 | 0.88 | ALDH1A1 (0.41) | ALDH1A1EGFRSMN1; SMN2KAT6ASLC16A3 | |
| SCHEMBL9524780 | 0.86 | FLT3 (0.43) | ALDH1A1EGFRKDM4ESMN1; SMN2NPC1 | |
| Hydrochloric Acid SCHEMBL9525215 | 0.83 | ALDH1A1 (0.41) | ALDH1A1PKMKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL9525116 | 0.81 | SMN1; SMN2 (0.46) | ALDH1A1EGFRKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL9527984 | 0.79 | SMN1; SMN2 (0.46) | ALDH1A1EGFRKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL9525975 | 0.78 | SMN1; SMN2 (0.43) | ALDH1A1HPGDSMN1; SMN2NPC1RAB9A | |
| SCHEMBL9525795 | 0.77 | SMN1; SMN2 (0.46) | ALDH1A1EGFRKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL9525162 | 0.76 | ALDH1A1 (0.51) | ALDH1A1PKMKDM4EHPGDSMN1; SMN2 | |
| SCHEMBL9524919 | 0.76 | HTT (0.51) | ALDH1A1EGFRKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL9528510 | 0.76 | SMN1; SMN2 (0.40) | ALDH1A1SMN1; SMN2NPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0301751-B1 | PYRIDINIUM DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1993-03-10 | — | — | EP | disclosed |
| US-4962113-A | PLATELET ACTIVATING FACTOR ANTAGONISTS | TAKEDA CHEMICAL INDUSTRIES, LTD (JP) | 1990-10-09 | — | — | US | disclosed |
| EP-0301751-A1 | Pyridinium derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1989-02-01 | — | — | EP | disclosed |