Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 14/20 | 0.42 |
| ▸ | TAS1R1 | Q7RTX1 | 13/20 | 0.42 |
| ▸ | TAS1R2 | Q8TE23 | 13/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1481978 | 0.87 | PTPN1 (0.44) | PTPN1GSK3BPKMSMN1; SMN2HTT | |
| SCHEMBL22795572 | 0.76 | TAS1R3 (0.46) | TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2 | |
| SCHEMBL13125484 | 0.73 | TAS1R3 (0.44) | TAS1R3TAS1R1TAS1R2SMN1; SMN2ALDH1A1 | |
| SCHEMBL9748198 | 0.73 | TAS1R3 (0.44) | TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2 | |
| SCHEMBL2860749 | 0.73 | TAS1R3 (0.44) | TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2 | |
| SCHEMBL12140043 | 0.72 | TAS1R3 (0.47) | TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2 | |
| SCHEMBL7652879 | 0.71 | TAS1R3 (0.42) | TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2 | |
| SCHEMBL2470702 | 0.70 | TAS1R3 (0.45) | TAS1R3TAS1R1TAS1R2SMN1; SMN2 | |
| SCHEMBL12629274 | 0.69 | TAS1R3 (0.48) | TAS1R3TAS1R1TAS1R2PKMSMN1; SMN2 | |
| Bicarbonate SCHEMBL27999118 | 0.69 | TAS1R3 (0.41) | TAS1R3TAS1R1TAS1R2SMN1; SMN2 |
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-5877193-A | NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1999-03-02 | — | — | US | disclosed |