Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 8/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22453533 | 0.89 | EPHX2 (0.40) | EPHX2CA2GRM4MEN1GAA | |
| SCHEMBL22453173 | 0.86 | HSP90AA1 (0.45) | EPHX2NPC1MEN1KMT2AHIF1A | |
| SCHEMBL22452799 | 0.84 | EPHX2 (0.53) | EPHX2NPC1CA1CA2CA9 | |
| SCHEMBL22453446 | 0.82 | NPC1 (0.44) | EPHX2NPC1MEN1GAAKMT2A | |
| SCHEMBL22452982 | 0.82 | CYP2C9 (0.48) | EPHX2NPC1CA1CA2CA9 | |
| SCHEMBL22452808 | 0.82 | CYP2C9 (0.48) | EPHX2NPC1CA1CA2CA9 | |
| SCHEMBL22452481 | 0.78 | PGR (0.48) | EPHX2NPC1MEN1GAAKMT2A | |
| SCHEMBL22453449 | 0.78 | HIF1A (0.51) | EPHX2NPC1CA1CA2CA9 | |
| SCHEMBL22453312 | 0.78 | SERPINE1 (0.43) | EPHX2NPC1CA1CA2MEN1 | |
| SCHEMBL22453248 | 0.77 | DHODH (0.49) | EPHX2NPC1CA1CA2CA9 |
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-2020190774-A1 | NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS | THE GENERAL HOSPITAL CORPORATION (US) | 2020-09-24 | — | — | WO | disclosed |