Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 2/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | TP53 | P04637 | 2/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 2/20 | 0.62 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MC4R | P32245 | 1/20 | 0.47 |
| ▸ | RAD52 | P43351 | 1/20 | 0.47 |
| ▸ | RARB | P10826 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | RARA | P10276 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PTGES | O14684 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Cetalkonium SCHEMBL9460493 | 1.00 | DNM1 (0.65) | DNM1MEN1KMT2ATP53MAPK1 | |
| Cetalkonium SCHEMBL9137135 | 0.93 | DNM1 (0.65) | DNM1MEN1KMT2ATP53MAPK1 | |
| Cetalkonium SCHEMBL9133901 | 0.93 | DNM1 (0.65) | DNM1MEN1KMT2ATP53MAPK1 | |
| Cetalkonium SCHEMBL10584924 | 0.90 | DNM1 (0.77) | DNM1MEN1KMT2ATP53MAPK1 | |
| Mecetronium SCHEMBL9460349 | 0.87 | DNM1 (0.50) | DNM1MEN1KMT2ATP53HTT | |
| Mecetronium SCHEMBL9459996 | 0.87 | DNM1 (0.50) | DNM1MEN1KMT2ATP53HTT | |
| SCHEMBL4747603 | 0.87 | DNM1 (0.66) | DNM1MEN1KMT2ATP53MAPK1 | |
| SCHEMBL5452094 | 0.87 | DNM1 (0.66) | DNM1MEN1KMT2ATP53MAPK1 | |
| Hydrochloric Acid SCHEMBL31414085 | 0.85 | MEN1 (0.67) | DNM1MEN1KMT2ATP53MAPK1 | |
| Hydrochloric Acid SCHEMBL31414084 | 0.85 | MEN1 (0.67) | DNM1MEN1KMT2ATP53MAPK1 |
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-5274184-A | Aryl sulphide, aryl sulphoxide and aryl sulphone compounds | CASSELLA AKTIENGESELLSCHAFT (DE) | 1993-12-28 | — | — | US | disclosed |