Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.59 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.59 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.59 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.59 |
| ▸ | MTOR | P42345 | 2/20 | 0.56 |
| ▸ | LSS | P48449 | 1/20 | 0.55 |
| ▸ | NAMPT | P43490 | 1/20 | 0.53 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.52 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.49 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | PPARA | Q07869 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.49 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL24575984 | 0.85 | MTOR (0.69) | HDAC3HDAC1HDAC2HDAC6HDAC10 | |
| SCHEMBL1695141 | 0.83 | MTOR (0.58) | HDAC3HDAC1HDAC2HDAC6HDAC10 | |
| SCHEMBL3897948 | 0.81 | CYP2C9 (0.59) | HDAC3HDAC1HDAC2HDAC6HDAC10 | |
| SCHEMBL4881592 | 0.81 | EPHX2 (0.61) | HDAC3HDAC6HDAC8EPHX2MEN1 | |
| SCHEMBL2629356 | 0.81 | LSS (0.59) | HDAC3HDAC1HDAC2HDAC6HDAC10 | |
| SCHEMBL4576236 | 0.79 | MTOR (0.54) | HDAC3HDAC1HDAC2HDAC6HDAC10 | |
| SCHEMBL3417449 | 0.79 | LSS (0.56) | HDAC3HDAC1HDAC2HDAC6HDAC10 | |
| SCHEMBL10594986 | 0.79 | HDAC3 (0.60) | HDAC3HDAC1HDAC2HDAC6HDAC10 | |
| SCHEMBL934145 | 0.79 | HDAC3 (0.60) | HDAC3HDAC1HDAC2HDAC6HDAC10 | |
| SCHEMBL5347157 | 0.78 | HDAC3 (0.55) | HDAC3HDAC1HDAC2HDAC6HDAC10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3543231-A1 | COMPOUNDS FOR TREATING CNS- AND NEURODEGENERATIVE DISEASES | ETH Zurich (CH) | 2019-09-25 | — | — | EP | disclosed |