Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 4/20 | 0.40 |
| ▸ | DRD3 | P35462 | 7/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.39 |
| ▸ | DRD2 | P14416 | 6/20 | 0.39 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL22452708 | 0.89 | EPHX2 (0.41) | EPHX2GRM4MEN1KMT2AHSP90AA1 | |
| SCHEMBL22452997 | 0.85 | EPHX2 (0.40) | EPHX2 | |
| SCHEMBL22452709 | 0.83 | LTC4S (0.40) | MEN1KMT2AALDH1A1GAA | |
| SCHEMBL22453033 | 0.80 | PGR (0.40) | EPHX2KMT2AALDH1A1 | |
| SCHEMBL22452975 | 0.79 | AURKA (0.36) | ALDH1A1CA2 | |
| SCHEMBL22453173 | 0.76 | HSP90AA1 (0.45) | EPHX2MEN1KMT2AALDH1A1HSP90AA1 | |
| SCHEMBL22453031 | 0.76 | PNLIP (0.37) | EPHX2 | |
| SCHEMBL22452799 | 0.74 | EPHX2 (0.53) | EPHX2CA2 | |
| SCHEMBL22452982 | 0.71 | CYP2C9 (0.48) | EPHX2MEN1KMT2ACA2 | |
| SCHEMBL22453268 | 0.70 | EPHX2 (0.55) | EPHX2MEN1KMT2A |
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 |