Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 9/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.42 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | MDH1 | P40925 | 2/20 | 0.40 |
| ▸ | MDH2 | P40926 | 2/20 | 0.40 |
| ▸ | EP300 | Q09472 | 1/20 | 0.40 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22453244 | 0.91 | SERPINE1 (0.47) | HIF1ANPC1CYP2C9EPAS1PGR | |
| SCHEMBL22453152 | 0.90 | CNR2 (0.47) | CNR2HIF1ANPC1EPAS1PGR | |
| SCHEMBL22452627 | 0.90 | CNR2 (0.51) | CNR2HIF1ANPC1EPAS1PGR | |
| SCHEMBL22453558 | 0.86 | CNR2 (0.47) | CNR2HIF1AEPAS1PGRMDH1 | |
| SCHEMBL22452628 | 0.85 | CNR2 (0.47) | CNR2HIF1ANPC1EPAS1PGR | |
| SCHEMBL22452654 | 0.83 | CNR2 (0.57) | CNR2HIF1ANPC1CYP2C9EPAS1 | |
| SCHEMBL22453560 | 0.82 | CNR2 (0.44) | CNR2HIF1ACYP2C9EPAS1PGR | |
| SCHEMBL22452666 | 0.81 | CNR2 (0.43) | CNR2HIF1AEPAS1PGRMDH1 | |
| SCHEMBL22453565 | 0.81 | CNR2 (0.61) | CNR2HIF1ANPC1CYP2C9EPAS1 | |
| SCHEMBL22453241 | 0.80 | NPC1 (0.44) | CNR2HIF1ANPC1EPAS1PGR |
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 |