Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.49 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | NSD2 | O96028 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9786714 | 0.86 | NPC1 (0.54) | NPC1RAB9AALDH1A1L3MBTL1GAA | |
| SCHEMBL10923604 | 0.79 | SLC22A12 (0.49) | NPC1RAB9AALDH1A1L3MBTL1GAA | |
| SCHEMBL7440629 | 0.77 | PDE3B (0.59) | ALDH1A1PDE3BPDE3AKMT2A | |
| SCHEMBL2726850 | 0.72 | MEN1 (0.65) | NPC1RAB9AL3MBTL1GAAMEN1 | |
| SCHEMBL10162070 | 0.71 | NPC1 (0.76) | NPC1RAB9AL3MBTL1GAAMEN1 | |
| SCHEMBL7425415 | 0.70 | PDE3B (0.58) | PDE3BPDE3A | |
| SCHEMBL7441966 | 0.69 | PDE3B (0.57) | NPC1RAB9APDE3BPDE3A | |
| SCHEMBL7435632 | 0.69 | PDE3B (0.57) | ALDH1A1PDE3BPDE3AHPGDKDM4E | |
| SCHEMBL30071250 | 0.69 | GAA (0.76) | NPC1RAB9AALDH1A1GAAMEN1 | |
| SCHEMBL626827 | 0.69 | GAA (0.76) | NPC1RAB9AALDH1A1GAAMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0312960-A2 | Method for reducing reperfusion injury with imidazol-2-thione-carboxamides | MERRELL DOW PHARMACEUTICALS INC. (US) | 1989-04-26 | — | — | EP | disclosed |