Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | METAP2 | P50579 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MASP2 | O00187 | 1/20 | 0.40 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30761772 | 0.84 | ALDH1A1 (0.56) | ALDH1A1HTTTSHRMASP2ABCC1 | |
| SCHEMBL7089269 | 0.84 | ALDH1A1 (0.56) | ALDH1A1HTTTSHRMASP2ABCC1 | |
| SCHEMBL4139764 | 0.79 | HTT (0.53) | ALDH1A1HTT | |
| SCHEMBL9470129 | 0.77 | NPC1 (0.44) | ALDH1A1HTT | |
| SCHEMBL30782571 | 0.77 | GAA (0.53) | ALDH1A1HTTMETAP2TSHRKDM4E | |
| SCHEMBL4048833 | 0.77 | GAA (0.53) | ALDH1A1HTTMETAP2TSHRKDM4E | |
| SCHEMBL5814278 | 0.77 | NPC1 (0.64) | ALDH1A1HTTKDM4E | |
| SCHEMBL3837851 | 0.76 | MAPT (0.52) | ALDH1A1HTTTSHR | |
| SCHEMBL23169175 | 0.76 | HTT (0.64) | ALDH1A1HTT | |
| SCHEMBL560265 | 0.76 | CYP1A2 (0.55) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5246951-A | Nonsteroidal antiinflammatory agents | ADIR ET COMPAGNIE (FR) | 1993-09-21 | — | — | US | claimed |