Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | STAT3 | P40763 | 1/20 | 0.46 |
| ▸ | STS | P08842 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7973346 | 0.83 | CTSD (0.50) | CTSDHPGDALDH1A1STAT3STS | |
| SCHEMBL7983681 | 0.82 | HCRTR1 (0.53) | HPGDALDH1A1HTTKCNK3KCNK9 | |
| SCHEMBL7990812 | 0.82 | IRAK4 (0.57) | ALDH1A1KCNK3KCNK9RXFP1 | |
| SCHEMBL7987106 | 0.80 | CTSD (0.46) | CTSDHPGDALDH1A1STAT3STS | |
| SCHEMBL7991085 | 0.79 | LMNA (0.54) | ALDH1A1SMN1; SMN2MAPTTSHRRXFP1 | |
| SCHEMBL7973382 | 0.77 | HPGD (0.42) | HPGDALDH1A1NPC1RAB9AHTT | |
| SCHEMBL7973356 | 0.75 | CES2 (0.50) | HPGDALDH1A1MAPT | |
| SCHEMBL7991022 | 0.75 | CES2 (0.50) | HPGDALDH1A1NPC1RAB9AHTT | |
| SCHEMBL7985043 | 0.75 | NPC1 (0.41) | HPGDALDH1A1NPC1RAB9AHTT | |
| SCHEMBL29228929 | 0.75 | CTSD (0.56) | CTSDHPGDALDH1A1STAT3STS |
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 |
|---|---|---|---|---|---|---|---|
| US-6331628-B1 | REACTING A SUBSTITUTED HALOBENZENE WITH POTASSIUM, SODIUM AND/OR ZINC CYANIDE IN THE PRESENCE OF A METALLIC CATALYST | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2001-12-18 | — | — | US | disclosed |