Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.67 |
| ▸ | GAA | P10253 | 3/20 | 0.67 |
| ▸ | PKM | P14618 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 7/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.63 |
| ▸ | HTT | P42858 | 3/20 | 0.63 |
| ▸ | POLB | P06746 | 4/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL28751662 | 0.84 | ALDH1A1 (0.76) | ALDH1A1L3MBTL1GAAPKMMAPT | |
| SCHEMBL31380218 | 0.83 | ALDH1A1 (0.74) | ALDH1A1L3MBTL1GAAPKMMAPT | |
| SCHEMBL17303454 | 0.83 | ALDH1A1 (0.79) | ALDH1A1L3MBTL1GAAPKMMAPT | |
| SCHEMBL2773960 | 0.83 | ALDH1A1 (0.74) | ALDH1A1L3MBTL1GAAPKMMAPT | |
| SCHEMBL29805521 | 0.82 | ALDH1A1 (0.77) | ALDH1A1L3MBTL1GAAPKMMAPT | |
| SCHEMBL2775026 | 0.82 | ALDH1A1 (0.77) | ALDH1A1L3MBTL1GAAPKMMAPT | |
| SCHEMBL31380191 | 0.82 | ALDH1A1 (0.72) | ALDH1A1L3MBTL1GAAPKMMAPT | |
| SCHEMBL2773181 | 0.82 | ALDH1A1 (0.77) | ALDH1A1L3MBTL1GAAPKMMAPT | |
| SCHEMBL15801120 | 0.81 | ALDH1A1 (0.75) | ALDH1A1L3MBTL1GAAPKMMAPT | |
| SCHEMBL29805427 | 0.81 | ALDH1A1 (0.75) | ALDH1A1L3MBTL1GAAPKMMAPT |
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-1421071-A2 | SUBSTITUTED PIPERAZINE AND DIAZEPANE DERIVAIVES AS HISTAMINE H3 RECEPTOR MODULATORS | NOVO NORDISK A/S (DK) | 2004-05-26 | — | — | EP | disclosed |
| WO-2003004480-A2 | SUBSTITUTED PIPERAZINE AND DIAZEPANES AS HISTAMINE H3 RECEPTOR AGONISTS | NOVO NORDISK A/S (DK) | 2003-01-16 | — | — | WO | disclosed |