Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.35 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.32 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | LOX | P28300 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CHKA | P35790 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | FSHR | P23945 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20606883 | 0.77 | HSP90AA1 (0.42) | HSP90AA1HSP90AB1ALDH1A1MAPTLOXL2 | |
| SCHEMBL21940793 | 0.74 | NUDT1 (0.41) | HSP90AA1HSP90AB1ALDH1A1MAPTLOXL2 | |
| SCHEMBL21940467 | 0.73 | IDH1 (0.36) | HSP90AA1HSP90AB1MBOAT4ALDH1A1MAPT | |
| SCHEMBL20606902 | 0.73 | HSP90AA1 (0.39) | HSP90AA1HSP90AB1ALDH1A1MAPTLOXL2 | |
| SCHEMBL21941067 | 0.73 | TLR7 (0.39) | HSP90AA1HSP90AB1ALDH1A1MAPTLOXL2 | |
| SCHEMBL21940590 | 0.72 | IDH1 (0.37) | HSP90AA1HSP90AB1ALDH1A1MAPTLOXL2 | |
| SCHEMBL20606989 | 0.72 | HSP90AA1 (0.38) | HSP90AA1HSP90AB1ALDH1A1MAPTLOXL2 | |
| SCHEMBL20242647 | 0.72 | TLR7 (0.43) | HSP90AA1HSP90AB1ALDH1A1MAPTLOXL2 | |
| SCHEMBL24760476 | 0.71 | GAA (0.46) | HSP90AA1HSP90AB1ALDH1A1MAPTKDM4E | |
| SCHEMBL8788157 | 0.68 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1ALDH1A1MAPTLOXL2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3423445-B1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS | GALAPAGOS NV (BE) | 2020-04-01 | — | — | EP | disclosed |