Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.30 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13980135 | 0.75 | CYP1A2 (0.32) | TSHRCYP1A2 | |
| SCHEMBL366594 | 0.73 | ALDH1A1 (0.48) | ALDH1A1TSHRKCNJ1TYRMEN1 | |
| SCHEMBL5233407 | 0.72 | ALDH1A1 (0.43) | ALDH1A1TSHRKCNJ1MEN1LMNA | |
| SCHEMBL4353272 | 0.72 | ALDH1A1 (0.50) | ALDH1A1TSHRKCNJ1TYRMEN1 | |
| SCHEMBL12433427 | 0.72 | CYP1A2 (0.33) | TSHRCYP1A2 | |
| SCHEMBL29818681 | 0.72 | ALDH1A1 (0.50) | ALDH1A1TSHRKCNJ1TYRMEN1 | |
| Hydrochloric Acid SCHEMBL28212658 | 0.72 | ALDH1A1 (0.46) | ALDH1A1TSHRKCNJ1TYRMEN1 | |
| SCHEMBL29818730 | 0.70 | ALDH1A1 (0.44) | ALDH1A1TSHRKCNJ1TYRMEN1 | |
| SCHEMBL1708271 | 0.68 | ALDH1A1 (0.43) | ALDH1A1TSHRKCNJ1MEN1LMNA | |
| SCHEMBL6438818 | 0.68 | ALDH1A1 (0.43) | ALDH1A1TSHRKCNJ1MEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-116133658-A | Novel compounds as inhibitors of histone deacetylase 6 and pharmaceutical compositions comprising the same | 株式会社 钟根堂 | 2023-05-16 | — | — | CN | disclosed |