Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | MLYCD | O95822 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9819120 | 0.94 | MEN1 (0.43) | GSK3BTRPV1RAB9AALDH1A1HTT | |
| SCHEMBL9819077 | 0.93 | MEN1 (0.48) | GSK3BTRPV1RAB9AALDH1A1HTT | |
| SCHEMBL9819392 | 0.93 | CNR1 (0.47) | GSK3BTRPV1RAB9ANPC1MEN1 | |
| SCHEMBL9819366 | 0.89 | TRPV1 (0.60) | GSK3BTRPV1RAB9AMLYCDNPC1 | |
| SCHEMBL9819082 | 0.89 | TRPV1 (0.60) | GSK3BTRPV1RAB9AMLYCDNPC1 | |
| SCHEMBL9819202 | 0.84 | KMT2A (0.46) | RAB9AALDH1A1SMN1; SMN2NPC1MEN1 | |
| SCHEMBL9819214 | 0.84 | GSK3B (0.51) | GSK3BRAB9AALDH1A1HTTMLYCD | |
| SCHEMBL9819129 | 0.84 | KMT2A (0.54) | RAB9AALDH1A1HTTSMN1; SMN2GAA | |
| SCHEMBL9819309 | 0.81 | GAA (0.58) | RAB9AALDH1A1HPGDHTTSMN1; SMN2 | |
| SCHEMBL9818928 | 0.81 | EPHX2 (0.50) | GSK3BTRPV1RAB9ANPC1EPHX2 |
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-5034410-A | Nitrile and oxo containing amides or thioamides | SYNTEX (U.S.A.) INC. (US) | 1991-07-23 | — | — | US | disclosed |