Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.36 |
| ▸ | GHSR | Q92847 | 6/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PPARD | Q03181 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.33 |
| ▸ | RXRB | P28702 | 1/20 | 0.33 |
| ▸ | RXRG | P48443 | 1/20 | 0.33 |
| ▸ | FASN | P49327 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | CTSC | P53634 | 1/20 | 0.32 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29587458 | 0.82 | HPGD (0.40) | HDAC3HDAC1HDAC2NPC1RAB9A | |
| SCHEMBL29587460 | 0.81 | SLC6A3 (0.39) | HDAC3HDAC1HDAC2PPARDPPARA | |
| SCHEMBL29587169 | 0.76 | HDAC3 (0.45) | HDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL29587290 | 0.76 | HDAC3 (0.51) | GHSRHDAC3HDAC1HDAC2RAB9A | |
| SCHEMBL29586900 | 0.75 | HDAC3 (0.44) | HDAC3HDAC1HDAC2 | |
| SCHEMBL29586783 | 0.75 | HDAC3 (0.44) | HDAC3HDAC1HDAC2 | |
| SCHEMBL29587076 | 0.75 | SLC6A3 (0.39) | HDAC3HDAC1HDAC2NPC1RAB9A | |
| SCHEMBL29587203 | 0.74 | PPARG (0.39) | PPARDPPARA | |
| SCHEMBL29587197 | 0.71 | PPARG (0.43) | HDAC3HDAC1HDAC2NPC1RAB9A | |
| SCHEMBL29587342 | 0.71 | CYP4F2 (0.35) | HDAC3HDAC1HDAC2 |
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-2022120048-A1 | HDAC INHIBITORS | UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2022-06-09 | — | — | WO | disclosed |