Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22453296 | 0.89 | HDAC3 (0.47) | HDAC3HDAC11HDAC8HDAC6DEGS1 | |
| SCHEMBL22452937 | 0.83 | DHODH (0.40) | TP53MAPTGAA | |
| SCHEMBL22453576 | 0.83 | CYP1A2 (0.40) | MAPTSMN1; SMN2NPC1 | |
| SCHEMBL22453719 | 0.77 | CYP1A2 (0.37) | MAPTSMN1; SMN2 | |
| SCHEMBL22453578 | 0.77 | MAPT (0.42) | MAPTSMN1; SMN2NPC1GAA | |
| SCHEMBL22452936 | 0.77 | NR1H4 (0.35) | TP53MAPTSMN1; SMN2 | |
| SCHEMBL22452648 | 0.76 | RAB9A (0.49) | HDAC3HDAC11HDAC8HDAC6DEGS1 | |
| SCHEMBL22452774 | 0.74 | MEN1 (0.52) | HDAC3HDAC11HDAC8HDAC6DEGS1 | |
| SCHEMBL22453482 | 0.71 | SMN1; SMN2 (0.53) | HDAC3HDAC11HDAC8HDAC6DEGS1 | |
| SCHEMBL22452929 | 0.70 | HDAC3 (0.62) | HDAC3HDAC11HDAC8HDAC6DEGS1 |
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 |