Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALB | P02768 | 2/20 | 0.52 |
| ▸ | CCR4 | P51679 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8304428 | 1.00 | ALB (0.52) | ALBCCR4HDAC1HDAC6ALDH1A1 | |
| SCHEMBL9641837 | 0.88 | ALB (0.46) | ALBMAOAMAOB | |
| SCHEMBL9641842 | 0.88 | ALB (0.46) | ALBMAOAMAOB | |
| SCHEMBL9260315 | 0.83 | ALB (0.49) | ALBCCR4MAPTMAOAMAOB | |
| SCHEMBL5777449 | 0.83 | ALB (0.49) | ALBCCR4MAPTMAOAMAOB | |
| SCHEMBL5775275 | 0.83 | ALB (0.52) | ALBMEN1ADORA3PTGS1KMT2A | |
| SCHEMBL5779807 | 0.82 | ALB (0.61) | ALBHDAC1HDAC6HDAC3HDAC4 | |
| SCHEMBL5776476 | 0.81 | NFE2L2 (0.52) | ALBALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL9515918 | 0.81 | NFE2L2 (0.52) | ALBALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL8306883 | 0.80 | ALB (0.49) | ALBCCR4HDAC1HDAC6ALDH1A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0469833-B1 | N-Benzyl-Indoles, processes for their preparation and pharmaceutical compositions containing them | LILLY CO ELI (GB) | 1999-09-08 | — | — | EP | disclosed |
| US-5281593-A | Pharmaceuticals | LILLY INDUSTRIES LIMITED (GB) | 1994-01-25 | — | — | US | disclosed |
| CN-1061413-A | Medicinal compound | LILLY INDUSTRIES LTD (GB) | 1992-05-27 | — | — | CN | disclosed |
| EP-0469833-A1 | N-Benzyl-Indoles, processes for their preparation and pharmaceutical compositions containing them | LILLY INDUSTRIES LIMITED (GB) | 1992-02-05 | — | — | EP | disclosed |
| US-4962117-A | ANTIINFLAMMATORY, ANTIASTHMATIC AND CYTOPROTECTIVE AGENTS; ANTIALLERGENS; LEUKOTRIENE ANTAGONISTS | MERCK FROSST CANADA, INC. (CA) | 1990-10-09 | — | — | US | disclosed |
| EP-0318085-A2 | Heterazole dialkanoic acids | MERCK FROSST CANADA INC. (CA) | 1989-05-31 | — | — | EP | disclosed |