Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TRAP1 | Q12931 | 6/20 | 0.35 |
| ▸ | HSP90B1 | P14625 | 5/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27831830 | 0.81 | TRAP1 (0.42) | LMNATRAP1HSP90B1HSP90AA1 | |
| SCHEMBL27831857 | 0.80 | HSP90AA1 (0.35) | TRAP1HSP90B1HSP90AA1TLR7 | |
| SCHEMBL27811666 | 0.79 | ALDH1A1 (0.38) | LMNATRAP1HSP90B1ALDH1A1PKM | |
| SCHEMBL1059577 | 0.75 | TRAP1 (0.59) | LMNATRAP1HSP90B1DDB1CRBN | |
| SCHEMBL27641254 | 0.73 | HSP90AA1 (0.49) | HSP90AA1 | |
| SCHEMBL27811517 | 0.71 | TRAP1 (0.34) | TRAP1HSP90B1HSP90AA1 | |
| SCHEMBL27831914 | 0.70 | TRAP1 (0.33) | TRAP1HSP90B1HSP90AA1 | |
| SCHEMBL27641134 | 0.70 | HSP90AA1 (0.48) | TRAP1HSP90B1HSP90AA1 | |
| SCHEMBL27831901 | 0.70 | TRAP1 (0.43) | LMNATRAP1HSP90B1KMT2AALDH1A1 | |
| SCHEMBL27641242 | 0.67 | HSP90AA1 (0.53) | TRAP1HSP90B1HSP90AA1 |
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-102098918-A | Bioactive compounds for treatment of cancer and neurodegenerative diseases | PONIARD PHARMACEUTICALS INC | 2011-06-15 | — | — | CN | disclosed |