Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.55 |
| ▸ | KMO | O15229 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.47 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31003876 | 0.91 | KMO (0.50) | S1PR1KMOKMT2AALDH1A1MEN1 | |
| SCHEMBL22452774 | 0.88 | MEN1 (0.52) | S1PR1KMOKMT2AALDH1A1MEN1 | |
| SCHEMBL22453482 | 0.88 | SMN1; SMN2 (0.53) | S1PR1KMT2AALDH1A1MEN1SERPINE1 | |
| SCHEMBL28592246 | 0.84 | KDM4E (0.49) | S1PR1KMOKMT2AALDH1A1MEN1 | |
| SCHEMBL22453749 | 0.82 | HDAC8 (0.57) | KMOKMT2AALDH1A1MEN1POLB | |
| SCHEMBL20400984 | 0.81 | S1PR1 (0.49) | S1PR1KMOKMT2AALDH1A1MEN1 | |
| SCHEMBL25053698 | 0.81 | MAPT (0.49) | KMT2AALDH1A1MEN1POLBNPC1 | |
| SCHEMBL22452648 | 0.78 | RAB9A (0.49) | KMT2AALDH1A1MEN1NPC1SMN1; SMN2 | |
| SCHEMBL25053696 | 0.78 | MAPT (0.44) | KMT2AALDH1A1MEN1NPC1SMN1; SMN2 | |
| SCHEMBL31003814 | 0.76 | KMO (0.54) | KMOKMT2AALDH1A1MEN1POLB |
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 |