Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | UNG | P13051 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 3/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | PGK1 | P00558 | 1/20 | 0.35 |
| ▸ | PGK2 | P07205 | 1/20 | 0.35 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.35 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4099672 | 0.80 | HDAC4 (0.53) | ALDH1A1UNGHDAC4HDAC2HDAC8 | |
| SCHEMBL4950119 | 0.79 | ALDH1A1 (0.48) | ALDH1A1UNGMAOAMAOBNPC1 | |
| SCHEMBL4808239 | 0.79 | ALDH1A1 (0.48) | ALDH1A1UNGMAOAMAOBRAB9A | |
| SCHEMBL14231960 | 0.79 | ALDH1A1 (0.41) | ALDH1A1UNGHDAC4HDAC2HDAC8 | |
| SCHEMBL663468 | 0.76 | MAOA (0.41) | ALDH1A1UNGMAOAMAOBNPC1 | |
| SCHEMBL30291836 | 0.75 | TYR (0.56) | ALDH1A1UNGHDAC4HDAC2HDAC8 | |
| SCHEMBL727874 | 0.75 | TYR (0.56) | ALDH1A1UNGHDAC4HDAC2HDAC8 | |
| SCHEMBL13779285 | 0.75 | UNG (0.39) | ALDH1A1UNGMAOAMAOBNPC1 | |
| SCHEMBL2048449 | 0.74 | PTGS2 (0.44) | ALDH1A1UNGMAOAMAOBNPC1 | |
| SCHEMBL9772613 | 0.73 | ACHE (0.44) | ALDH1A1HDAC4HDAC2HDAC8TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4868241-A | POLYVINYL ALCOHOL MODIFIED WITH BENZOIC ACID DERIVATIVE | AMERICAN CYANAMID COMPANY (US) | 1989-09-19 | — | — | US | disclosed |