Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FBP1 | P09467 | 14/20 | 0.64 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.64 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | FDPS | P14324 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | FLT3 | P36888 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14406851 | 0.81 | FBP1 (0.58) | FBP1PDK1HTR7FDPSALDH1A1 | |
| SCHEMBL191350 | 0.79 | FBP1 (1.00) | FBP1PDK1HTR7FDPSALDH1A1 | |
| SCHEMBL1366302 | 0.78 | — | — | |
| SCHEMBL11445382 | 0.76 | — | — | |
| SCHEMBL28079135 | 0.75 | FBP1 (0.80) | FBP1PDK1HTR7FDPSALDH1A1 | |
| SCHEMBL11825683 | 0.73 | FBP1 (0.58) | FBP1PDK1HTR7FDPSALDH1A1 | |
| SCHEMBL28382830 | 0.73 | FBP1 (0.76) | FBP1PDK1HTR7FDPSALDH1A1 | |
| SCHEMBL9731968 | 0.71 | — | — | |
| SCHEMBL8371244 | 0.71 | — | — | |
| SCHEMBL11445138 | 0.71 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4130562-A | Odorant or flavoring thiazolyl disulphides | GIVAUDAN CORPORATION (US) | 1978-12-19 | — | — | US | claimed |
| US-4237290-A | ODORANTS, FLAVORINGS; REACTION OF A SULFONIUM SALT AND A MERCAPTAN | GIVAUDAN CORPORATION (US) | 1980-12-02 | — | — | US | disclosed |
| US-4188488-A | ALKYLIMIDAZOLYL SUBSTITUENTS | GIVAUDAN CORPORATION (US) | 1980-02-12 | — | — | US | disclosed |
| US-4170594-A | Oxazolyl-alkyl-disulphides as flavorants | GIVAUDAN CORPORATION (US) | 1979-10-09 | — | — | US | disclosed |
| US-4130562-A | Odorant or flavoring thiazolyl disulphides | GIVAUDAN CORPORATION (US) | 1978-12-19 | — | — | US | disclosed |