Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SKP2 | Q13309 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.38 |
| ▸ | CYP4F11 | Q9HBI6 | 1/20 | 0.38 |
| ▸ | CYP4F12 | Q9HCS2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | PPARA | Q07869 | 4/20 | 0.36 |
| ▸ | PPARG | P37231 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23114374 | 0.81 | SKP2 (0.49) | SKP2CYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL22115129 | 0.78 | ABL1 (0.38) | CYP3A4CYP1A2CYP2C9CYP2C19MEN1 | |
| SCHEMBL21124409 | 0.77 | PAX8 (0.33) | HDAC3HDAC1HDAC2NCOR2PPARA | |
| SCHEMBL21124407 | 0.77 | P2RX3 (0.35) | HDAC3HDAC1HDAC2NCOR2PPARA | |
| SCHEMBL20671184 | 0.75 | AAK1 (0.40) | ALDH1A1NPC1RAB9ALMNAL3MBTL1 | |
| SCHEMBL30369795 | 0.75 | ABL1 (0.39) | CYP1A2CYP2C9CYP2C19ALDH1A1MEN1 | |
| SCHEMBL30116140 | 0.75 | AAK1 (0.40) | ALDH1A1NPC1RAB9ALMNAL3MBTL1 | |
| SCHEMBL18157855 | 0.75 | ABL1 (0.39) | CYP1A2CYP2C9CYP2C19ALDH1A1MEN1 | |
| SCHEMBL177445 | 0.75 | THRA (0.47) | CYP3A4ALDH1A1HSD17B10KDM4EMEN1 | |
| SCHEMBL23092965 | 0.74 | SKP2 (0.58) | SKP2CYP3A4CYP1A2CYP2D6CYP2C9 |
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-2021050547-A1 | MITOCHONDRIAL COMPLEX I INHIBITORS AND METHODS OF USE | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-03-18 | — | — | WO | disclosed |