Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL29086343 | 0.84 | HSP90AA1 (0.47) | ALDH1A1HTTSMN1; SMN2LMNAMEN1 | |
| Hydrochloric Acid SCHEMBL29488818 | 0.84 | HSP90AA1 (0.47) | ALDH1A1HTTSMN1; SMN2LMNAMEN1 | |
| SCHEMBL4244929 | 0.82 | TSHR (0.48) | ALDH1A1ACHESMN1; SMN2SLC6A2SLC6A4 | |
| SCHEMBL18799364 | 0.82 | ACHE (0.54) | ALDH1A1ACHEMEN1KMT2A | |
| SCHEMBL2608042 | 0.82 | ACHE (0.54) | ALDH1A1ACHEMEN1KMT2A | |
| SCHEMBL4048996 | 0.75 | GAA (0.47) | ALDH1A1ACHESMN1; SMN2 | |
| SCHEMBL2956426 | 0.75 | HSP90AA1 (0.43) | ALDH1A1HTTSMN1; SMN2MAPK1 | |
| SCHEMBL4246710 | 0.74 | NPC1 (0.52) | ACHEHPGD | |
| SCHEMBL4060240 | 0.74 | ALDH1A1 (0.47) | ALDH1A1HTTSMN1; SMN2LMNAMEN1 | |
| SCHEMBL3344245 | 0.74 | ACHE (0.61) | ACHESLC6A3LMNAKMT2A |
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-2049118-A1 | MORPHOLINYL AND PYRROLIDINYL ANALOGS | SmithKline Beecham Corporation (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008011551-A1 | MORPHOLINYL AND PYRROLIDINYL ANALOGS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-01-24 | — | — | WO | disclosed |