Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.32 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL21724865 | 0.89 | KDM4E (0.43) | RIPK1ALDH1A1NPC1KDM4EGAA | |
| SCHEMBL21724519 | 0.85 | GAA (0.41) | ALDH1A1NPC1KDM4EGAARAB9A | |
| SCHEMBL21723579 | 0.84 | RIPK1 (0.42) | RIPK1NPC1KDM4EPGRCHRM4 | |
| SCHEMBL21723841 | 0.83 | LMNA (0.41) | ALDH1A1GAALMNAMEN1KMT2A | |
| SCHEMBL21723936 | 0.82 | GAA (0.49) | ALDH1A1NPC1KDM4EGAARAB9A | |
| SCHEMBL21723904 | 0.76 | LMNA (0.31) | LMNA | |
| SCHEMBL21723933 | 0.76 | MEN1 (0.46) | RIPK1ALDH1A1NPC1KDM4ECHRM4 | |
| SCHEMBL21724346 | 0.75 | ALDH1A1 (0.47) | ALDH1A1NPC1RAB9ALMNA | |
| SCHEMBL21723556 | 0.74 | PKM (0.33) | ALDH1A1LMNAP2RX7 | |
| SCHEMBL21724804 | 0.74 | DAO (0.43) | RIPK1ALDH1A1NPC1RAB9ALMNA |
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 2 patents. 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 | claimed |
| WO-2020035826-A1 | 1,2-DITHIOLONE COMPOUNDS AND USE THEREOF | PI INDUSTRIES LTD. (IN) | 2020-02-20 | — | — | WO | disclosed |