Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 3/20 | 0.35 |
| ▸ | CTSB | P07858 | 2/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | CASR | P41180 | 2/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.30 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8323561 | 0.78 | CTSS (0.35) | ALDH1A1PKMCTSSCTSBCTSL | |
| SCHEMBL8323557 | 0.77 | LMNA (0.35) | ALDH1A1PKMCTSSCTSBCTSL | |
| SCHEMBL8326703 | 0.76 | PLA2G1B (0.38) | ALDH1A1PKMCTSSCTSBCTSL | |
| SCHEMBL13995922 | 0.75 | TACR1 (0.41) | ALDH1A1PKMMEN1KMT2ATACR1 | |
| SCHEMBL8327295 | 0.74 | IDO1 (0.40) | ALDH1A1MEN1KMT2ATACR1LMNA | |
| SCHEMBL8329466 | 0.70 | NRP1 (0.33) | ALDH1A1CTSSCTSBCTSLMEN1 | |
| SCHEMBL172705 | 0.69 | TACR1 (0.46) | TACR1BCHE | |
| SCHEMBL13995917 | 0.67 | TACR1 (0.46) | CTSSCTSLKMT2ATACR1BCHE | |
| SCHEMBL2155993 | 0.66 | TACR1 (0.43) | CTSSTACR1CASRBCHEPPARA | |
| SCHEMBL8622887 | 0.66 | NPC1 (0.44) | ALDH1A1MEN1KMT2ALMNACASR |
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 |
|---|---|---|---|---|---|---|---|
| US-5753654-A | GASTROINTESTINAL DISORDERS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-05-19 | — | — | US | disclosed |
| US-5736550-A | TREATMENT OF GASTROINTESTINAL TRACT DISORDERS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-04-07 | — | — | US | disclosed |