Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | AKT2 | P31751 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | LSS | P48449 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6971987 | 0.95 | ALDH1A1 (0.42) | ALDH1A1HTTRAB9ANPC1DAO | |
| SCHEMBL6961731 | 0.89 | ALDH1A1 (0.49) | ALDH1A1HTTRAB9ANPC1DAO | |
| SCHEMBL6966618 | 0.89 | ALDH1A1 (0.47) | ALDH1A1HTTRAB9ANPC1P2RX7 | |
| SCHEMBL6969265 | 0.87 | ALDH1A1 (0.41) | ALDH1A1HTTRAB9ANPC1P2RX7 | |
| SCHEMBL9024637 | 0.84 | ALDH1A1 (0.37) | ALDH1A1HTTRAB9ANPC1DAO | |
| SCHEMBL9078864 | 0.84 | ALDH1A1 (0.37) | ALDH1A1HTTRAB9ANPC1DAO | |
| SCHEMBL9024045 | 0.82 | AOC3 (0.41) | ALDH1A1HTTRAB9ANPC1P2RX7 | |
| SCHEMBL224352 | 0.82 | DAO (0.41) | ALDH1A1HTTDAOTSHRKMT2A | |
| SCHEMBL6973527 | 0.82 | LTB4R (0.46) | ALDH1A1HTTRAB9AAOC3 | |
| SCHEMBL6970199 | 0.78 | RAB9A (0.40) | ALDH1A1HTTRAB9ANPC1P2RX7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0729459-B1 | PHENYL-ALKYL IMIDAZOLES AS H3-RECEPTOR ANTAGONISTS | SCHERING CORP (US) | 2003-03-12 | — | — | EP | disclosed |
| US-5578616-A | ANTIINFLAMMATORY AGENTS, ANTIALLERGENS, TREATMENT FOR GASTROINTESTINAL AND CARDIOVASCULAR DISORDERS | SCHERING CORPORATION (US) | 1996-11-26 | — | — | US | disclosed |