Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | SERPINE1 | P05121 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.39 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.36 |
| ▸ | DNMT3L | Q9UJW3 | 1/20 | 0.36 |
| ▸ | DNMT3A | Q9Y6K1 | 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 | |
|---|---|---|---|---|
| SCHEMBL22452982 | 0.95 | CYP2C9 (0.48) | CYP2C9PGRSERPINE1NPC1CA1 | |
| SCHEMBL22452808 | 0.95 | CYP2C9 (0.48) | CYP2C9PGRSERPINE1NPC1CA1 | |
| SCHEMBL22452799 | 0.86 | EPHX2 (0.53) | PGRNPC1CA1CA2CA9 | |
| SCHEMBL22453671 | 0.85 | PGR (0.43) | CYP2C9PGRSERPINE1NPC1CA1 | |
| SCHEMBL22453295 | 0.84 | PGR (0.44) | CYP2C9PGRNPC1EPHX2LMNA | |
| SCHEMBL22453116 | 0.81 | HIF1A (0.47) | CYP2C9PGRNPC1CA1CA2 | |
| SCHEMBL22452481 | 0.80 | PGR (0.48) | CYP2C9PGRSERPINE1NPC1HIF1A | |
| SCHEMBL22453446 | 0.79 | NPC1 (0.44) | CYP2C9PGRNPC1HIF1AEPHX2 | |
| SCHEMBL22452688 | 0.78 | HIF1A (0.46) | CYP2C9PGRSERPINE1NPC1CA1 | |
| SCHEMBL22453637 | 0.77 | FAAH (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 |