Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 2/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30768169 | 0.82 | NPC1 (0.41) | ALDH1A1MAPTRAB9AMEN1NPC1 | |
| SCHEMBL30670498 | 0.78 | KDR (0.50) | ALDH1A1MAPTRAB9AMEN1NPC1 | |
| SCHEMBL32661517 | 0.75 | AURKA (0.34) | ALDH1A1MAPTRAB9AMEN1NPC1 | |
| SCHEMBL29137721 | 0.74 | CAMK2D (0.40) | AURKA | |
| SCHEMBL30768170 | 0.72 | MEN1 (0.38) | ALDH1A1MAPTRAB9AMEN1NPC1 | |
| SCHEMBL32661546 | 0.72 | ACACB (0.37) | ALDH1A1MAPTRAB9AMEN1NPC1 | |
| SCHEMBL32662613 | 0.69 | BRD4 (0.42) | MAPTAURKAGAA | |
| SCHEMBL31563705 | 0.69 | BRD4 (0.42) | MAPTAURKAGAA | |
| SCHEMBL6845265 | 0.69 | ROCK2 (0.46) | ROCK2ALDH1A1MAPTRAB9AMEN1 | |
| SCHEMBL7872530 | 0.67 | ROCK2 (0.44) | ROCK2ALDH1A1MAPTRAB9AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117384153-A | Methyltransferase inhibitors and uses thereof | 上海赛岚生物科技有限公司 | 2024-01-12 | — | — | CN | disclosed |