Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.50 |
| ▸ | RAB9A | P51151 | 6/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | FBP1 | P09467 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1121674 | 0.85 | NPC1 (0.53) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL8579088 | 0.84 | HPGD (0.54) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL11181260 | 0.80 | NPC1 (0.51) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL2213224 | 0.79 | HPGD (0.56) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL1520869 | 0.78 | NPC1 (0.53) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL6703333 | 0.77 | KMT2A (0.53) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL11738365 | 0.75 | RAB9A (0.61) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL4398615 | 0.75 | ALDH1A1 (0.54) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL10542029 | 0.74 | HPGD (0.51) | NPC1RAB9AHPGDMAPTALDH1A1 | |
| SCHEMBL6614654 | 0.74 | RAB9A (0.60) | NPC1RAB9AHPGDMAPTALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0591763-B1 | Use of thioalkanediones as flavouring agents | HAARMANN & REIMER GMBH (DE) | 1998-07-29 | — | — | EP | disclosed |
| US-5466827-A | IMPARTING A MEATY AROMA TO A FOOD | HAARMANN & REIMER GMBH (DE) | 1995-11-14 | — | — | US | disclosed |
| EP-0591763-A1 | Use of thioalkanediones as flavouring agents | HAARMANN & REIMER GMBH (DE) | 1994-04-13 | — | — | EP | disclosed |