Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | LIPE | Q05469 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 4/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21724332 | 0.89 | RIPK1 (0.44) | KDM4EALDH1A1RIPK1RAB9ANPC1 | |
| SCHEMBL21724519 | 0.84 | GAA (0.41) | KDM4EALDH1A1RAB9ANPC1MEN1 | |
| SCHEMBL21723841 | 0.82 | LMNA (0.41) | ALDH1A1MEN1KMT2AGAATAAR1 | |
| SCHEMBL21723936 | 0.82 | GAA (0.49) | KDM4EALDH1A1RAB9ANPC1MEN1 | |
| SCHEMBL21724346 | 0.80 | ALDH1A1 (0.47) | ALDH1A1RAB9ANPC1ACHE | |
| SCHEMBL21723625 | 0.79 | PSEN1 (0.41) | KDM4EALDH1A1 | |
| SCHEMBL10852766 | 0.79 | RAB9A (0.46) | KDM4EALDH1A1RAB9ANPC1MEN1 | |
| SCHEMBL21724487 | 0.77 | RIPK1 (0.33) | RIPK1 | |
| SCHEMBL21724804 | 0.77 | DAO (0.43) | ALDH1A1RIPK1RAB9ANPC1TDP1 | |
| SCHEMBL21723556 | 0.74 | PKM (0.33) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020035826-A1 | 1,2-DITHIOLONE COMPOUNDS AND USE THEREOF | PI INDUSTRIES LTD. (IN) | 2020-02-20 | — | — | WO | disclosed |